SCHEMBL27937801

SCHEMBL27937801

CCCCc1ccc2c(NC)cccc2c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.47
▸ SKP2 Q13309 1/20 0.39
▸ PSMB5 P28074 1/20 0.39
▸ METAP2 P50579 1/20 0.39
▸ PTPN1 P18031 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ SIGMAR1 Q99720 1/20 0.37
▸ PLK1 P53350 1/20 0.37
▸ S1PR1 P21453 1/20 0.37
▸ S1PR3 Q99500 1/20 0.37
▸ BCHE P06276 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
SCHEMBL27937790 0.94 TRPV1 (0.46) TRPV1S1PR1S1PR3
SCHEMBL28807531 0.94 TRPV1 (0.46) TRPV1S1PR1S1PR3
SCHEMBL27937777 0.88 TRPV1 (0.53) TRPV1SKP2METAP2SIGMAR1PLK1
SCHEMBL27937950 0.83 CYP1A2 (0.50) CASP6
SCHEMBL27919136 0.83 TRPV1 (0.40) TRPV1PSMB5PTPN1BCHE
SCHEMBL27919200 0.82 TRPV1 (0.48) TRPV1
SCHEMBL27919206 0.82 TRPV1 (0.48) TRPV1
SCHEMBL5542995 0.78 NPC1 (0.49) TRPV1PTPN1
SCHEMBL28805670 0.78 KDM4E (0.42) CASP6SIGMAR1
SCHEMBL5542991 0.78 TRPV1 (0.43) TRPV1SKP2PSMB5SIGMAR1S1PR1

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
CN-103298772-B Method for producing aromatic alcohol or heterocyclic aromatic alcohol MITSUBISHI GAS CHEMICAL CO 2015-06-24 — — CN disclosed
CN-103298772-A Method for producing aromatic alcohol or heterocyclic aromatic alcohol MITSUBISHI GAS CHEMICAL CO 2013-09-11 — — CN disclosed
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