SCHEMBL18666144

SCHEMBL18666144

c1ccc2c(c1)[nH]c1cc3ccc4c5ccccc5oc4c3cc12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.49
▸ KIF11 P52732 11/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ GPR3 P46089 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ TOP2A P11388 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ DYRK1A Q13627 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
SCHEMBL18553281 0.94 AHR (0.53) AHRKIF11ALDH1A1GPR3HSD17B10
SCHEMBL18666428 0.88 CDK4 (0.43) AHRALDH1A1HSD17B10CYP1A2ALOX5
SCHEMBL18666121 0.83 CYP1A2 (0.40) AHRALDH1A1HSD17B10CYP1A2ALOX5
SCHEMBL21128608 0.82 AHR (0.49) AHRKIF11ALDH1A1GPR3HSD17B10
SCHEMBL18666044 0.81 AHR (0.50) AHRKIF11ALDH1A1GPR3HSD17B10
SCHEMBL21781179 0.80 CYP1A2 (0.47) AHRKIF11ALDH1A1GPR3HSD17B10
SCHEMBL19831835 0.79 AHR (0.53) AHRKIF11ALDH1A1GPR3HSD17B10
SCHEMBL18553445 0.79 CYP1A2 (0.40) AHRALDH1A1HSD17B10CYP1A2TOP2A
SCHEMBL18553436 0.79 AHR (0.49) AHRKIF11ALDH1A1GPR3HSD17B10
SCHEMBL787216 0.78 ALOX5 (0.59) AHRKIF11ALDH1A1GPR3HSD17B10

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-10934308-B2 Compound for organic electronic element, organic electronic element using same, and electronic device comprising same DUK SAN NEOLUX CO., LTD. (KR) 2021-03-02 — — US disclosed
WO-2017048025-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2017-03-23 — — 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-10934308-B2 Compound for organic electronic element, organic electronic element using same, and electronic device comprising same OR51E2, NFE2L2, ETV6 AHR 2334/4885KIF11 2204/4885ALDH1A1 814/4885

“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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