SCHEMBL19255486

SCHEMBL19255486

Ic1cccnc1-c1nnnn1I

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.35
CYP2A6 P11509 1/20 0.32
P2RX7 Q99572 2/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HSD11B1 P28845 1/20 0.30
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20375444 0.83 CYP2A6 (0.46) CYP2A6P2RX7ALDH1A1NPC1TSHR
SCHEMBL20684740 0.81 KMO (0.38) KCNN4CYP2A6P2RX7ALDH1A1HSD11B1
SCHEMBL19254853 0.76 P2RX7 (0.37) KCNN4P2RX7ALDH1A1L3MBTL1HSD11B1
SCHEMBL19255485 0.73 KCNN4 (0.55) KCNN4P2RX7ALDH1A1NPC1TSHR
SCHEMBL21465920 0.72 P2RX7 (0.43) KCNN4P2RX7
SCHEMBL29249875 0.72 HDAC8 (0.45) CYP2A6ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL31092839 0.72 HDAC8 (0.45) CYP2A6ALDH1A1TP53TSHRSMN1; SMN2
SCHEMBL23113874 0.66 ALDH1A1 (0.50) P2RX7ALDH1A1L3MBTL1HSD11B1TSHR
SCHEMBL18429912 0.66 KCNJ1 (0.41) CYP2A6P2RX7ALDH1A1L3MBTL1HSD11B1
SCHEMBL19255489 0.66 ALDH1A1 (0.36) KCNN4P2RX7ALDH1A1L3MBTL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912724-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-02-27 US disclosed
US-11807654-B2 Organometallic compound, organic light-emitting device including organometallic compound, and diagnostic composition including organometallic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-11-07 US disclosed
US-11678566-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-06-13 US disclosed
US-20210167303-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND UNIVERSITY OF ULSAN FOUNDATION FOR INDUSTRY COOPERATION (KR) 2021-06-03 US disclosed
US-10944063-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-03-09 US disclosed
US-10941171-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-03-09 US disclosed
US-20210028374-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-01-28 US disclosed
US-20200354393-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KP) 2020-11-12 US disclosed
US-20200203635-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-06-25 US disclosed
US-20200199164-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG SDI CO., LTD. (KR) 2020-06-25 US disclosed
US-10446763-B2 Organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-10-15 US disclosed
US-10326086-B2 Organometallic compound, composition containing the organometallic compound, and organic light-emitting device including the organometallic compound or composition SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-06-18 US disclosed
US-9735376-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-08-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210028374-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME L1CAM, AP1M1, PYM1 KCNN4 1721/4885CYP2A6 1184/4885P2RX7 3543/4885
US-10944063-B2 Organometallic compound and organic light-emitting device including the same CRY1, LEF1, POU2F1 KCNN4 3121/4885CYP2A6 624/4885P2RX7 4206/4885
US-11912724-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device L1CAM, FOXM1, CHRM1 KCNN4 658/4885CYP2A6 835/4885P2RX7 2239/4885
US-20200354393-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING ORGANOMETALLIC COMPOUND L1CAM, FOXM1, MEN1 KCNN4 2651/4885CYP2A6 2542/4885P2RX7 4395/4885
US-10326086-B2 Organometallic compound, composition containing the organometallic compound, and organic light-emitting device including the organometallic compound or composition ORC3, LEF1, AP1M1 KCNN4 3781/4885CYP2A6 877/4885P2RX7 3591/4885
US-11678566-B2 Organometallic compound and organic light-emitting device including the same L1CAM, AP1M1, PYM1 KCNN4 1721/4885CYP2A6 1184/4885P2RX7 3543/4885
US-20200199164-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND L1CAM, MEN1, NOM1 KCNN4 3513/4885CYP2A6 2151/4885P2RX7 4337/4885
US-20210167303-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND L1CAM, NOM1, FOXM1 KCNN4 3297/4885CYP2A6 2201/4885P2RX7 4119/4885
US-11807654-B2 Organometallic compound, organic light-emitting device including organometallic compound, and diagnostic composition including organometallic compound L1CAM, FOXM1, MEN1 KCNN4 2651/4885CYP2A6 2542/4885P2RX7 4395/4885
US-10941171-B2 Organometallic compound and organic light-emitting device including the same CRY1, LEF1, POU2F1 KCNN4 3121/4885CYP2A6 624/4885P2RX7 4206/4885
US-20200203635-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND L1CAM, MEN1, AP1M1 KCNN4 3491/4885CYP2A6 1275/4885P2RX7 3376/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.