SCHEMBL9831938

SCHEMBL9831938

COc1ccc(-c2nc(C)c(C(=O)Nc3nnn[nH]3)s2)cc1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.49
MAPT P10636 8/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KMT2A Q03164 3/20 0.47
KDM4E B2RXH2 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 2/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 4/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 3/20 0.46
MEN1 O00255 2/20 0.45
LMNA P02545 2/20 0.45
ROCK1 Q13464 1/20 0.45
ALOX5 P09917 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
SCHEMBL9830987 0.90 GAA (0.54) MAPTSMN1; SMN2KMT2AKDM4ERAB9A
SCHEMBL9829467 0.89 ROCK1 (0.42) PPARAMAPTSMN1; SMN2KMT2ANPC1
SCHEMBL9832642 0.88 SMN1; SMN2 (0.64) PPARAMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL9830803 0.87 ALDH1A1 (0.62) MAPTSMN1; SMN2KMT2ARAB9ANPC1
SCHEMBL9832312 0.87 ROCK1 (0.51) MAPTSMN1; SMN2KMT2AKDM4ERAB9A
SCHEMBL9823493 0.86 KDM4E (0.46) MAPTSMN1; SMN2KMT2AKDM4ERAB9A
SCHEMBL9832252 0.84 MAPT (0.43) MAPTSMN1; SMN2KMT2AKDM4EPOLB
SCHEMBL9830151 0.81 MAPT (0.46) PPARAMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL9823479 0.80 TLR7 (0.61) MAPTSMN1; SMN2KMT2AKDM4ERAB9A
SCHEMBL9830334 0.76 RAB9A (0.48) MAPTSMN1; SMN2KMT2AKDM4ERAB9A

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-0321115-B1 CARBOXAMIDE DERIVATIVES HAVING TETRAZOLE AND THIAZOLE RINGS AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-14 EP disclosed
US-4946855-A ANTIALLERGIC SAWAI PHARMACEUTICAL CO., LTD. (JP) 1990-08-07 US disclosed
EP-0321115-A1 Carboxamide derivatives having tetrazole and thiazole rings and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-06-21 EP disclosed