SCHEMBL10489988

SCHEMBL10489988

CCc1cccc(NC(=O)Oc2cccc(Cl)c2)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 2/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ KMT2A Q03164 6/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 4/20 0.41
▸ GAA P10253 1/20 0.41
▸ TRPV1 Q8NER1 1/20 0.40
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40
▸ RXRG P48443 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPK1 P28482 1/20 0.40

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
SCHEMBL10489876 0.87 RAB9A (0.50) FAAHNPC1RAB9ANPSR1KMT2A
SCHEMBL10489678 0.81 ALDH1A1 (0.54) NPC1RAB9ANPSR1KMT2AKDM4E
SCHEMBL10489904 0.81 RAB9A (0.60) FAAHNPC1RAB9AKMT2AKDM4E
SCHEMBL10489739 0.79 CLCN2 (0.45) KDM4EALDH1A1
SCHEMBL10489704 0.79 TRPV1 (0.45) FAAHNPC1RAB9ANPSR1KMT2A
SCHEMBL10489991 0.78 RAB9A (0.44) FAAHNPC1RAB9ANPSR1KMT2A
SCHEMBL10489667 0.77 PPARA (0.49) FAAHNPC1RAB9ANPSR1TRPV1
SCHEMBL10489851 0.76 ALDH1A1 (0.56) NPC1RAB9AKMT2AKDM4EMEN1
SCHEMBL10489802 0.76 PPARA (0.54) FAAHKDM4E
SCHEMBL10490000 0.76 KMT2A (0.40) KMT2AMEN1GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4873232-A ARTHRITIS AND AUTOIMMUNE DISEASES SYNTEX (US) 1989-10-10 — — US disclosed
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