SCHEMBL9829889

SCHEMBL9829889

Nc1csc(-c2ccco2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.58
HSD17B10 Q99714 6/20 0.58
ALDH1A1 P00352 7/20 0.51
CYP19A1 P11511 1/20 0.50
KDM4E B2RXH2 5/20 0.47
PKM P14618 4/20 0.47
RAB9A P51151 2/20 0.47
GFER P55789 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
MEN1 O00255 4/20 0.45
ALOX15 P16050 4/20 0.45
KMT2A Q03164 4/20 0.45
POLB P06746 4/20 0.45
BLM P54132 4/20 0.45
HPGD P15428 3/20 0.45
CASP1 P29466 3/20 0.45
CASP7 P55210 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
ADORA2A P29274 3/20 0.45
ADORA1 P30542 3/20 0.45

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
SCHEMBL7253210 0.81 CYP19A1 (0.72) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL10144382 0.78 CYP19A1 (0.50) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL21823786 0.78 CYP19A1 (0.50) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
Hydrochloric Acid SCHEMBL27350547 0.76 CYP19A1 (0.49) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
Hydrochloric Acid SCHEMBL27339401 0.76 CYP19A1 (0.49) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL16767195 0.75 MAPT (0.65) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL21823775 0.74 PIM1 (0.55) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL513242 0.74 ALDH1A1 (0.53) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL17773148 0.74 CYP19A1 (0.46) MAPTHSD17B10ALDH1A1CYP19A1KDM4E
SCHEMBL12190539 0.74 CYP19A1 (0.46) MAPTHSD17B10ALDH1A1CYP19A1KDM4E

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