SCHEMBL6580244

SCHEMBL6580244

CC(=O)c1cc(NC(=O)c2ccc(C)cc2)ccc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.64
RAB9A P51151 11/20 0.64
MAPT P10636 7/20 0.55
SMN1; SMN2 Q16637 5/20 0.55
NFKB1 P19838 3/20 0.55
NFKB2 Q00653 3/20 0.55
RELA Q04206 3/20 0.55
ALDH1A1 P00352 3/20 0.55
KDM4E B2RXH2 2/20 0.55
ALOX15 P16050 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
KLK7 P49862 1/20 0.55
F2 P00734 1/20 0.55
F10 P00742 1/20 0.55
PLAU P00749 1/20 0.55
PLAT P00750 1/20 0.55

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
SCHEMBL6346820 0.86 KMT2A (0.65) NPC1RAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL6580095 0.84 NPC1 (0.67) NPC1RAB9ASMN1; SMN2NFKB1NFKB2
SCHEMBL6581908 0.84 NPC1 (0.56) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL2605544 0.83 KCNMA1 (0.66) NPC1RAB9AMAPTSMN1; SMN2NFKB1
SCHEMBL10527844 0.82 HSD17B10 (0.54) NPC1RAB9AMAPTSMN1; SMN2NFKB1
SCHEMBL6581663 0.81 MAPT (0.58) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL11192829 0.81 NPC1 (0.64) NPC1RAB9AMAPTSMN1; SMN2NFKB1
SCHEMBL6582707 0.80 TRPV1 (0.52) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6580139 0.80 NPC1 (0.63) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL7609498 0.80 KMT2A (0.75) NPC1RAB9AMAPTSMN1; SMN2NFKB1

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