SCHEMBL1509735

SCHEMBL1509735

O=C(Cn1ccnc1)c1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.71
CYP11B1 P15538 1/20 0.68
CYP11B2 P19099 1/20 0.68
TBXAS1 P24557 1/20 0.64
ALPG P10696 2/20 0.63
ALPI P09923 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
PLAA Q9Y263 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
CYP51A1 Q16850 1/20 0.61
ALDH1A1 P00352 1/20 0.59

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
Hydrochloric Acid SCHEMBL410578 0.98 CYP19A1 (0.69) CYP19A1CYP11B1CYP11B2TBXAS1ALPG
SCHEMBL10247417 0.91 CYP19A1 (0.68) CYP19A1CYP11B1CYP11B2ALPGALPI
Hydrochloric Acid SCHEMBL412291 0.89 CYP19A1 (0.67) CYP19A1CYP11B1CYP11B2ALPGALPI
SCHEMBL11131296 0.88 CYP19A1 (0.70) CYP19A1CYP11B1CYP11B2TBXAS1ALPG
SCHEMBL12045380 0.88 CYP19A1 (0.70) CYP19A1CYP11B1CYP11B2ALPGALPI
SCHEMBL27559825 0.88 CYP19A1 (0.79) CYP19A1CYP11B1CYP11B2ALPGALPI
SCHEMBL11362294 0.87 CYP19A1 (0.65) CYP19A1CYP11B1CYP11B2ALPGALPI
Hydrochloric Acid SCHEMBL9996128 0.87 CYP19A1 (0.69) CYP19A1CYP11B1CYP11B2TBXAS1ALPG
Hydrochloric Acid SCHEMBL9996048 0.87 CYP19A1 (0.69) CYP19A1CYP11B1CYP11B2ALPGALPI
SCHEMBL11020478 0.85 CYP19A1 (0.63) CYP19A1CYP11B1CYP11B2ALPGALPI

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 126 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017077550-A1 A METAL FREE PROCESS FOR THE PREPARATION OF ALPHA-SUBSTITUTED CARBONYL COMPOUNDS FROM ALKENES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-05-11 WO claimed
CN-1013444-B PROCESS FOR THE PREPARATION OF A NOVEL CLASS OF HYPOGLYCEMIC AGENTS LILLY CO ELI (US) 1991-08-07 CN claimed
EP-0182533-B1 3-(2-ARYL-2-OXOETHYL)-IMIDAZOLIUM SALTS AS HYPOGLYCEMIC AGENTS ELI LILLY AND COMPANY (US) 1989-09-20 EP claimed
EP-0309953-A1 5-Substituted-3-phenyl-3-(1H-imidazol-1-ylmethyl)-2-methyl-isoxazolidines FISONS CORPORATION (US) 1989-04-05 EP claimed
CN-85108115-A The preparation method of new low point hypoglycaemic agent 1986-07-30 CN claimed
EP-0182533-A2 3-(2-Aryl-2-oxoethyl)-imidazolium salts as hypoglycemic agents ELI LILLY AND COMPANY (US) 1986-05-28 EP claimed
JP-59013762-A None JP disclosed
CN-115073448-A Application of fused ring heterocyclic compound or pharmaceutically acceptable salt thereof in preparation of medicine for treating cerebral apoplexy 浙江大学 2022-09-20 CN disclosed
CN-115073449-A Fused ring heterocyclic compound and application thereof, and pharmaceutical composition containing fused ring heterocyclic compound and application thereof 浙江大学 2022-09-20 CN disclosed
CN-115068471-A Application of fused ring heterocyclic compound or pharmaceutically acceptable salt thereof in preparation of drugs for treating Parkinson's disease 浙江大学 2022-09-20 CN disclosed
WO-2022188876-A1 FUSED RING HETEROCYCLIC COMPOUND AND APPLICATION THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AND APPLICATION THEREOF 浙江大学 2022-09-15 WO disclosed
CN-109320458-B Diaryl imidazole-containing compound, preparation method and medical application thereof 中国药科大学 2022-05-31 CN disclosed
US-11048168-B2 Permanent dielectric compositions containing photoacid generator and base PROMERUS, LLC (US) 2021-06-29 US disclosed
EP-0061794-A1 Antimicrobial imidazole derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1982-10-06 EP disclosed
US-4351948-A Imidazole hydrazone derivatives G.D. SEARLE & CO. (US) 1982-09-28 US disclosed
EP-0055059-A1 Diazole and triazole derivatives, processes for their preparation and anti-microbial compositions containing them SANKYO COMPANY LIMITED (JP) 1982-06-30 EP disclosed
EP-0049913-A2 New ethenylimidazole derivatives, processes for their preparation and pharmaceutical compositions containing them; intermediates, useful in their preparation and a process for the preparation thereof GIST-BROCADES N.V. (NL) 1982-04-21 EP disclosed
US-4210656-A BACTERICIDES, FUNGICIDES SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-07-01 US disclosed
EP-0003560-A2 Imidazole derivatives and salts thereof, their synthesis, and pharmaceutical formulations THE WELLCOME FOUNDATION LIMITED (GB) 1979-08-22 EP disclosed
US-4055652-A 1-[β(R-thio)phenethyl]imidazoles and derivatives thereof SYNTEX (U.S.A.) INC. (US) 1977-10-25 US disclosed