SCHEMBL9823368

SCHEMBL9823368

Cc1ccc(-c2nc(C(=O)Nc3nnn[nH]3)c(C)s2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 2/20 0.45
TBK1 Q9UHD2 2/20 0.45
PARP1 P09874 1/20 0.41
RAB9A P51151 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 2/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
POLB P06746 1/20 0.37
COMT P21964 1/20 0.36
TP53 P04637 1/20 0.35

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
SCHEMBL9823493 0.89 KDM4E (0.46) RAB9AKDM4EGAAMEN1KMT2A
SCHEMBL9823324 0.87 TBK1 (0.45) IKBKETBK1RAB9AKDM4EGAA
SCHEMBL9830987 0.83 GAA (0.54) RAB9AKDM4EGAAMEN1KMT2A
SCHEMBL9823172 0.83 PARP1 (0.35) IKBKETBK1PARP1RAB9AMEN1
SCHEMBL9823518 0.80 KDM4E (0.45) RAB9AKDM4EMEN1KMT2AALDH1A1
SCHEMBL9823799 0.79 RAB9A (0.61) RAB9AGAAMEN1KMT2AALDH1A1
SCHEMBL9830797 0.76 RAB9A (0.39) IKBKETBK1RAB9AKDM4EGAA
SCHEMBL9832642 0.74 SMN1; SMN2 (0.64) RAB9AKDM4EGAAMEN1KMT2A
SCHEMBL9831821 0.74 MAPT (0.46) RAB9AKDM4EGAAMEN1KMT2A
SCHEMBL9830916 0.74 RAB9A (0.45) IKBKETBK1RAB9AKDM4EGAA

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-0262873-B1 N-TETRAZOLYL THIAZOLECARBOXAMIDE DERIVATIVES AND THEIR USE SAWAI PHARMACEUTICAL CO., LTD. (JP) 1991-08-21 EP disclosed
US-4879295-A ANTIALLERGENS SAWAI PHARMACEUTICAL CO., LTD. (JP) 1989-11-07 US disclosed
EP-0262873-A1 N-tetrazolyl thiazolecarboxamide derivatives and their use SAWAI PHARMACEUTICAL CO., LTD. (JP) 1988-04-06 EP disclosed