SCHEMBL18630461

SCHEMBL18630461

Cc1cccc2ccc(I)cc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.63
CYP2A6 P11509 6/20 0.63
ALDH1A1 P00352 5/20 0.57
HSD17B10 Q99714 4/20 0.57
HPGD P15428 2/20 0.57
TSHR P16473 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
CYP3A4 P08684 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TYMS P04818 1/20 0.40
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
HIF1A Q16665 1/20 0.34
CYP1B1 Q16678 1/20 0.34
DAO P14920 1/20 0.34
DDO Q99489 1/20 0.34
KDM2B Q8NHM5 2/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL18880908 0.84 CYP1A2 (0.55) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL24787587 0.84 CYP1A2 (0.55) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL18810167 0.83 CYP1A2 (0.63) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL597735 0.77 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL29470563 0.77 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL6562931 0.77 ALDH1A1 (0.38) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL19880330 0.77 ALDH1A1 (0.38) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL598230 0.76 CYP1A2 (0.65) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
SCHEMBL1402259 0.76 CYP1A2 (0.65) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD
Ammonia Solution, Strong SCHEMBL27919256 0.76 CYP1A2 (0.95) CYP1A2CYP2A6ALDH1A1HSD17B10HPGD

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230323016-A1 AMBIENT TEMPERATURE CURABLE COATING AND USES THEREIN WASHINGTON STATE UNIVERSITY 2023-10-12 US disclosed
WO-2023177216-A1 ORGANIC ELECTRIC ELEMENT INCLUDING COMPOUND FOR ORGANIC ELECTRIC ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-09-21 WO disclosed
EP-3730488-B1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEMICAL LTD (KR) 2023-08-09 EP disclosed
US-11696499-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-04 US disclosed
US-20230200217-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed
US-20230135917-A1 LIGHT-EMITTING DEVICE AND METHOD OF MANUFACTURING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-04 US disclosed
US-11563182-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-01-24 US disclosed
US-11538999-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2022-12-27 US disclosed
US-11527727-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2022-12-13 US disclosed
US-20220165957-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2022-05-26 US disclosed
US-20170200899-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-13 US disclosed
US-20170194569-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170186969-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-29 US disclosed
US-20170186978-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-29 US disclosed
US-20170186975-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-29 US disclosed
US-20170155054-A1 ORGANIC LIGHT-EMITTING DEVICE DUK SAN NEOLUX CO., LTD. (KR) 2017-06-01 US disclosed
US-20170133590-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-11 US disclosed
US-20170125690-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-04 US disclosed
US-20170125697-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-04 US disclosed
US-20170077419-A1 CARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-16 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 (4 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-11538999-B2 Heterocyclic compound and organic light-emitting device including the same CCNT1, CYP1A1, CRY1 CYP1A2 37/4885CYP2A6 530/4885ALDH1A1 35/4885
US-11527727-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof OR51E2, NFE2L2, ETV6 CYP1A2 2472/4885CYP2A6 1794/4885ALDH1A1 1401/4885
US-20170077419-A1 CARBAZOLE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME OCIAD1, OXA1L, CYP1A1 CYP1A2 42/4885CYP2A6 786/4885ALDH1A1 202/4885
US-11563182-B2 Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof TCF7, MCM7, LUC7L2 CYP1A2 1274/4885CYP2A6 758/4885ALDH1A1 1278/4885

“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.