SCHEMBL11206265

SCHEMBL11206265

O=C(COc1ccc(Cn2ccnc2)cc1)Nc1nnn[nH]1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 8/20 0.61
CYP19A1 P11511 5/20 0.49
PKM P14618 2/20 0.47
GAA P10253 1/20 0.44
NPC1 O15118 1/20 0.44
ALPL P05186 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL11207086 0.81 TBXAS1 (0.67) TBXAS1CYP19A1PKMGAA
SCHEMBL10947477 0.79 TBXAS1 (0.72) TBXAS1CYP19A1PKMGAA
SCHEMBL11213142 0.78 TBXAS1 (0.63) TBXAS1CYP19A1PKMNPC1RAB9A
SCHEMBL11208084 0.77 TBXAS1 (0.62) TBXAS1CYP19A1PKMNPC1RAB9A
SCHEMBL10852178 0.76 TBXAS1 (1.00) TBXAS1CYP19A1
SCHEMBL10944753 0.76 TBXAS1 (0.53) TBXAS1CYP19A1
SCHEMBL11354168 0.76 TBXAS1 (0.74) TBXAS1CYP19A1
SCHEMBL10945811 0.75 TBXAS1 (0.78) TBXAS1CYP19A1
Hydrochloric Acid SCHEMBL10854369 0.75 TBXAS1 (1.00) TBXAS1CYP19A1
SCHEMBL11208640 0.74 TBXAS1 (0.65) TBXAS1GAASMN1; SMN2LMNA

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-0035863-B1 IMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF Pfizer Limited (GB) 1983-10-26 EP claimed
US-4350696-A INHIBITORS OF THROMBOXANE SYNTHETASE ENZYME PFIZER INC. (US) 1982-09-21 US claimed
EP-0035863-A1 Imidazole derivatives, process for their preparation and pharmaceutical compositions thereof Pfizer Limited (GB) 1981-09-16 EP claimed