SCHEMBL9829752

SCHEMBL9829752

COc1ccc(-c2csc(NC(=O)c3nnn[nH]3)n2)cc1OC

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.65
KMT2A Q03164 10/20 0.65
MAPK1 P28482 3/20 0.65
ALDH1A1 P00352 3/20 0.65
ALOX15 P16050 1/20 0.65
HSD17B10 Q99714 1/20 0.65
POLB P06746 4/20 0.60
RAB9A P51151 2/20 0.58
NPC1 O15118 1/20 0.58
LMNA P02545 2/20 0.57
GPR65 Q8IYL9 1/20 0.57
KDM4E B2RXH2 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
PAX8 Q06710 1/20 0.55
MAPT P10636 3/20 0.55
MCL1 Q07820 1/20 0.55
HPGD P15428 1/20 0.54
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL9829242 0.86 ADORA3 (0.60) MEN1KMT2AMAPK1ALDH1A1HSD17B10
SCHEMBL9830542 0.84 ALDH1A1 (0.66) MEN1KMT2AALDH1A1HSD17B10POLB
SCHEMBL9829548 0.84 MEN1 (0.59) MEN1KMT2AALDH1A1POLBRAB9A
SCHEMBL9829907 0.82 LMNA (0.59) MEN1KMT2AMAPK1ALDH1A1HSD17B10
SCHEMBL9830897 0.82 MAPT (0.56) MEN1KMT2AMAPK1ALDH1A1POLB
SCHEMBL9829872 0.82 RAB9A (0.62) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL9832583 0.80 LMNA (0.57) MEN1KMT2AMAPK1ALDH1A1ALOX15
SCHEMBL9831892 0.80 ABL1 (0.60) MEN1KMT2AMAPK1ALDH1A1RAB9A
SCHEMBL9829808 0.80 RAB9A (0.58) MEN1KMT2AMAPK1ALOX15HSD17B10
SCHEMBL18029531 0.80 MEN1 (1.00) MEN1KMT2AMAPK1ALDH1A1ALOX15

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