SCHEMBL18553281

SCHEMBL18553281

c1ccc2c(c1)[nH]c1cc3c(ccc4c5ccccc5oc34)cc12

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.53
▸ TOP2A P11388 1/20 0.44
▸ KIF11 P52732 12/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ GPR3 P46089 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ DYRK1A Q13627 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37

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
SCHEMBL18666144 0.94 AHR (0.49) AHRTOP2AKIF11ALDH1A1GPR3
SCHEMBL18553436 0.85 AHR (0.49) AHRTOP2AKIF11ALDH1A1GPR3
SCHEMBL18666428 0.82 CDK4 (0.43) AHRALDH1A1HSD17B10KDM4EMAPT
SCHEMBL19831835 0.82 AHR (0.53) AHRTOP2AKIF11ALDH1A1GPR3
SCHEMBL18553445 0.82 CYP1A2 (0.40) AHRTOP2AALDH1A1HSD17B10KDM4E
SCHEMBL18553629 0.81 AHR (0.55) AHRTOP2AKIF11ALDH1A1GPR3
SCHEMBL24341366 0.80 CDK4 (0.43) AHRKDM4EMAPT
SCHEMBL21128608 0.79 AHR (0.49) AHRTOP2AKIF11ALDH1A1GPR3
SCHEMBL17464183 0.79 DYRK1A (0.44) AHRALDH1A1HSD17B10KDM4EMAPT
SCHEMBL19108670 0.78 AHR (0.50) AHRALDH1A1HSD17B10KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11299459-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2022-04-12 — — US disclosed
WO-2017030307-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC APPARATUS COMPRISING SAME 덕산네오룩스 주식회사 2017-02-23 — — WO 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 (1 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-11299459-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof PIEZO1, OCIAD1, TMEM109 AHR 3687/4885TOP2A 3743/4885KIF11 2133/4885

“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.

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