SCHEMBL9830040

SCHEMBL9830040

COc1ccc(-c2nc(N)cs2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.61
CDC25B P30305 1/20 0.61
MAPT P10636 5/20 0.59
ALDH1A1 P00352 6/20 0.58
KDM4E B2RXH2 5/20 0.58
RAB9A P51151 3/20 0.58
POLB P06746 2/20 0.58
ATM Q13315 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 2/20 0.57
HPGD P15428 1/20 0.54
TP53 P04637 1/20 0.53
HSD17B10 Q99714 1/20 0.53
LTA4H P09960 1/20 0.53
CYP19A1 P11511 2/20 0.52
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
DYRK1A Q13627 1/20 0.49

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
SCHEMBL9831109 0.82 CYP1A1 (0.67) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL9830244 0.80 ALDH1A1 (0.63) MAPTALDH1A1KDM4ERAB9AATM
SCHEMBL13394699 0.80 MAPT (0.73) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL2096148 0.80 MAPT (0.61) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL1180215 0.80 MAPT (0.84) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL9831572 0.79 SMN1; SMN2 (0.56) MAPTALDH1A1KDM4ERAB9APOLB
SCHEMBL20390901 0.79 CYP19A1 (0.47) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL2277599 0.79 CDC25A (0.45) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL28570238 0.79 KDM4E (0.62) CDC25ACDC25BMAPTALDH1A1KDM4E
SCHEMBL2096147 0.79 MAPT (0.59) CDC25ACDC25BMAPTALDH1A1KDM4E

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 5 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
EP-0001727-B1 NEW DERIVATIVES OF 4-PHENYL-2-(2',2',2-TRICHLORETHOXYCARBOXAMIDO)-THIAZOLE USEFUL AS MEDICAMENTS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR THE PREPARATION OF THESE COMPOUNDS PIERRE FABRE S.A. (FR) 1981-11-11 EP disclosed
EP-0001727-A2 New derivatives of 4-phenyl-2-(2',2',2-trichlorethoxycarboxamido)-thiazole useful as medicaments, pharmaceutical compositions containing them and process for the preparation of these compounds PIERRE FABRE S.A. (FR) 1979-05-02 EP disclosed