SCHEMBL6580185

SCHEMBL6580185

CCCCc1ccc(C(=O)Nc2ccc(O)c(C(C)=O)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.61
KDM4E B2RXH2 2/20 0.58
NPC1 O15118 1/20 0.54
GALR3 O60755 1/20 0.54
RAB9A P51151 1/20 0.54
PLK1 P53350 3/20 0.54
MAPT P10636 1/20 0.51
POLB P06746 1/20 0.50
CCR5 P51681 1/20 0.49
ALOX15 P16050 2/20 0.49

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
SCHEMBL6581728 0.89 ALOX15 (0.57) TRPV1NPC1RAB9APLK1POLB
SCHEMBL6577799 0.89 ALOX15 (0.57) TRPV1KDM4ENPC1RAB9APOLB
SCHEMBL6581908 0.87 NPC1 (0.56) TRPV1NPC1RAB9APLK1MAPT
SCHEMBL11190894 0.85 TRPV1 (0.61) TRPV1KDM4ENPC1GALR3RAB9A
SCHEMBL4326686 0.84 TRPV1 (0.76) TRPV1KDM4ENPC1GALR3RAB9A
SCHEMBL6579798 0.84 NR1H4 (0.61) KDM4ENPC1RAB9AMAPT
SCHEMBL11192040 0.81 TRPV1 (0.56) TRPV1KDM4ENPC1GALR3RAB9A
SCHEMBL8756485 0.81 PLK1 (0.57) TRPV1PLK1
SCHEMBL1415882 0.80 KAT8 (0.67) TRPV1NPC1RAB9AMAPTALOX15
SCHEMBL11188309 0.80 PLK1 (0.56) TRPV1KDM4EPLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0716088-B1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL CO (JP) 2004-02-18 EP disclosed
US-5597929-A Production process of 2-(tetrazol-5-yl)-4-oxo-4H-benzopyran SUMITOMO CHEMICAL CO., LTD. (JP) 1997-01-28 US disclosed
EP-0716088-A1 PROCESS FOR PRODUCING 2-(TETRAZOL-5-YL)-4-OXO-4H-BENZOPYRANS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-12 EP disclosed