SCHEMBL9879185

SCHEMBL9879185

COc1ccc(-c2n[c]c(C)o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.54
RAB9A P51151 10/20 0.54
KMT2A Q03164 1/20 0.54
KDM4E B2RXH2 7/20 0.49
ALDH1A1 P00352 6/20 0.49
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
HPGD P15428 5/20 0.49
HSD17B10 Q99714 3/20 0.49
TP53 P04637 2/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
USP2 O75604 1/20 0.47
NOTUM Q6P988 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
GSK3B P49841 2/20 0.44
CYP2C19 P33261 2/20 0.43
POLB P06746 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL1435790 0.82 ALDH1A1 (0.45) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL1435997 0.78 NPC1 (0.44) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL1435933 0.78 NPC1 (0.50) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL504678 0.77 NPC1 (0.47) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL1435709 0.76 ENPP3 (0.50) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL13004548 0.72 NPC1 (0.85) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL1596616 0.72 KDM4E (0.59) NPC1KMT2AKDM4EALDH1A1MAPT
SCHEMBL2360960 0.70 NPC1 (0.73) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL201926 0.69 TARBP2 (0.56) NPC1RAB9AKMT2AKDM4EALDH1A1
SCHEMBL17877090 0.69 NPC1 (0.96) NPC1RAB9AKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1026234-C Thiazolidinedione derivatives for lowering blood glucose PFIZER (US) 1994-10-19 CN disclosed
WO-1991003474-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1991-03-21 WO disclosed
CN-1036572-A Thiazolidinedione derivatives for lowering blood glucose PFIZER (US) 1989-10-25 CN disclosed
WO-1989008651-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1989-09-21 WO disclosed
WO-1989008652-A1 THIAZOLIDINEDIONE DERIVATIVES AS HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1989-09-21 WO disclosed
EP-0332332-A1 Hypoglycemic thiazolidinedione derivatives PFIZER INC. (US) 1989-09-13 EP disclosed