SCHEMBL21668946

SCHEMBL21668946

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3ccc(-n5c6ccccc6c6c7oc8ccccc8c7ccc65)cc34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
TSHR P16473 4/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 9/20 0.33
LMNA P02545 5/20 0.32
KDM4E B2RXH2 3/20 0.32
POLB P06746 3/20 0.32
HSD17B10 Q99714 2/20 0.32
CHEK2 O96017 1/20 0.32
MAPK1 P28482 1/20 0.32
PTGER4 P35408 1/20 0.32
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
GAA P10253 1/20 0.32
PRKDC P78527 1/20 0.32
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.31
NPC1 O15118 1/20 0.31
AHR P35869 1/20 0.31

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
SCHEMBL21883297 0.96 ALDH1A1 (0.32) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL21740464 0.96 TSHR (0.35) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL15785856 0.95 ALDH1A1 (0.34) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL17827274 0.95 CHEK2 (0.33) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL27444658 0.94 ALDH1A1 (0.34) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL21365546 0.94 ALDH1A1 (0.35) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL27444621 0.94 TSHR (0.31) ALDH1A1TSHRKDM4EPOLBHSD17B10
SCHEMBL27444629 0.94 TSHR (0.35) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL22352492 0.93 ALDH1A1 (0.33) ALDH1A1TSHRHPGDMAPTLMNA
SCHEMBL27444650 0.93 ALDH1A1 (0.34) ALDH1A1TSHRHPGDMAPTLMNA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11785844-B2 Organic light emitting device, method for manufacturing same and composition for organic material layer LT MATERIALS CO., LTD. (KR) 2023-10-10 US disclosed
US-11785844-B2 Organic light emitting device, method for manufacturing same and composition for organic material layer LT MATERIALS CO., LTD. (KR) 2023-10-10 US disclosed
US-11387418-B2 Organic light emitting element and composition for organic material layer in organic light emitting element LT MATERIALS CO., LTD. (KR) 2022-07-12 US disclosed
US-20210057651-A1 ORGANIC LIGHT EMITTING DEVICE, METHOD FOR MANUFACTURING SAME AND COMPOSITION FOR ORGANIC MATERIAL LAYER LT MATERIALS CO., LTD. (KR) 2021-02-25 US disclosed
US-20200381629-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2020-12-03 US disclosed
US-20200119285-A1 ORGANIC LIGHT EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER IN ORGANIC LIGHT EMITTING ELEMENT HEESUNG MATERIAL LTD. (KR) 2020-04-16 US disclosed
EP-3604297-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME Heesung Material Ltd. (KR) 2020-02-05 EP 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 (3 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-11387418-B2 Organic light emitting element and composition for organic material layer in organic light emitting element CRY1, CYBA, L1CAM ALDH1A1 66/4885TSHR 4716/4885HPGD 1875/4885
US-20200119285-A1 ORGANIC LIGHT EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER IN ORGANIC LIGHT EMITTING ELEMENT CRY1, CYBA, L1CAM ALDH1A1 66/4885TSHR 4716/4885HPGD 1875/4885
US-20200381629-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 ALDH1A1 15/4885TSHR 4080/4885HPGD 1764/4885

“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.