SCHEMBL9832642

SCHEMBL9832642

Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1nnn[nH]1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.64
MAPT P10636 8/20 0.61
GAA P10253 3/20 0.61
RAB9A P51151 4/20 0.56
NPC1 O15118 4/20 0.56
POLB P06746 2/20 0.56
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
CYP2D6 P10635 1/20 0.54
XDH P47989 1/20 0.54
ALDH1A1 P00352 7/20 0.52
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50

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 0.91 GAA (0.54) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL9830803 0.88 ALDH1A1 (0.62) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL9831938 0.88 PPARA (0.49) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL9829467 0.81 ROCK1 (0.42) SMN1; SMN2MAPTGAANPC1POLB
SCHEMBL9832312 0.80 ROCK1 (0.51) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL9829758 0.80 SMN1; SMN2 (0.51) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL9832252 0.78 MAPT (0.43) SMN1; SMN2MAPTPOLBKDM4EMEN1
SCHEMBL9823541 0.78 RAB9A (0.61) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL14800165 0.76 GAA (1.00) SMN1; SMN2MAPTGAARAB9ANPC1
SCHEMBL9831974 0.75 DDX3X (0.44) SMN1; SMN2MAPTGAARAB9ANPC1

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