SCHEMBL9524748

SCHEMBL9524748

O=C1Nc2ccccc2C(c2ccccc2)=NC1O

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
LMNA P02545 2/20 0.71
ALB P02768 1/20 0.71
ALDH1A1 P00352 1/20 0.61
CCKBR P32239 11/20 0.57
CCKAR P32238 6/20 0.57
HDAC1 Q13547 1/20 0.57
PGR P06401 1/20 0.54
CHRM1 P11229 1/20 0.54
BACE1 P56817 1/20 0.52

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
SCHEMBL9524753 1.00 MEN1 (0.71) MEN1KMT2ALMNAALBALDH1A1
SCHEMBL2615325 0.83 LMNA (0.73) MEN1KMT2ALMNAALBALDH1A1
Oxazepam SCHEMBL27435 0.83 LMNA (1.00) MEN1KMT2ALMNAALBCCKBR
Oxazepam SCHEMBL29803925 0.83 LMNA (1.00) MEN1KMT2ALMNAALBCCKBR
SCHEMBL14160193 0.83 LMNA (0.73) MEN1KMT2ALMNAALBALDH1A1
SCHEMBL14213392 0.83 LMNA (0.73) MEN1KMT2ALMNAALBALDH1A1
Oxazepam SCHEMBL528376 0.83 LMNA (1.00) MEN1KMT2ALMNAALBCCKBR
Oxazepam SCHEMBL5498881 0.83 LMNA (1.00) MEN1KMT2ALMNAALBCCKBR
Oxazepam SCHEMBL9614141 0.83 LMNA (1.00) MEN1KMT2ALMNAALBCCKBR
Oxazepam SCHEMBL13746806 0.83 LMNA (1.00) MEN1KMT2ALMNAALBCCKBR

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9273012-B2 Facile preparation of 4-substituted quinazolines and related heterocycles UNIVERSITY OF HOUSTON SYSTEM (US) 2016-03-01 US disclosed
US-20120283436-A1 FACILE PREPARATION OF 4-SUBSTITUTED QUINAZOLINES AND RELATED HETEROCYCLES THE UNIVERSITY OF HOUSTON (US) 2012-11-08 US disclosed
WO-2012151141-A2 A FACILE PREPARATION OF 4-SUBSTITUTED QUINAZOLINES AND RELATED HETEROCYCLES UNIVERSITY OF HOUSTON SYSTEM (US) 2012-11-08 WO disclosed
EP-0167919-B1 BENZODIAZEPINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK & CO. INC. (US) 1993-05-05 EP disclosed
US-5004741-A Cholecystokinin(CCK); Treating Disorders Of The Gastrointestinal Tract, Central Nervous System And Of The Appetite Of Animals MERCK & CO., INC. (US) 1991-04-02 US disclosed
US-4820834-A Benzodiazepine analogs MERCK & CO., INC. (US) 1989-04-11 US disclosed
EP-0284256-A1 Benzodiazepine analogs MERCK & CO. INC. (US) 1988-09-28 EP disclosed
EP-0167919-A2 Benzodiazepine derivatives and pharmaceutical compositions containing them MERCK & CO. INC. (US) 1986-01-15 EP disclosed
US-4065451-A CNS DEPRESSANTS AMERICAN HOME PRODUCTS (US) 1977-12-27 US disclosed
US-4065451-A CNS DEPRESSANTS AMERICAN HOME PRODUCTS (US) 1977-12-27 US disclosed
US-3886276-A 1,3-Dihydro-3 -hydroxy-5-phenyl-2H-1,4-benzodiazepin-2-one, substituted diamino acetate esters and their acid salts in compositions and methods for inducing a calming effect AMERICAN HOME PROD 1975-05-27 US disclosed