SCHEMBL7311422

SCHEMBL7311422

O=C(O)C(=NO)C1=Nc2ccc(Cl)cc2C(c2ccccc2F)=NC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.47
CHRM1 P11229 1/20 0.45
AURKA O14965 2/20 0.42
CYP3A4 P08684 2/20 0.41
DRD3 P35462 2/20 0.41
OPRK1 P41145 2/20 0.41
SLC22A1 O15245 1/20 0.41
ABCB11 O95342 1/20 0.41
PDE4D Q08499 1/20 0.41
HTR1A P08908 1/20 0.40
HTR3A P46098 1/20 0.40
KCNH2 Q12809 1/20 0.40
GHSR Q92847 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL7311417 1.00 LMNA (0.47) LMNACHRM1AURKACYP3A4DRD3
SCHEMBL7473846 0.92 LMNA (0.45) LMNACHRM1AURKACYP3A4DRD3
SCHEMBL7473843 0.92 LMNA (0.45) LMNACHRM1AURKACYP3A4DRD3
SCHEMBL7317293 0.89 GABRA1 (0.46) LMNAOPRK1PDE4DTP53
SCHEMBL7317291 0.89 GABRA1 (0.46) LMNAOPRK1PDE4DTP53
SCHEMBL7313894 0.88 LMNA (0.44) LMNACHRM1AURKACYP3A4DRD3
SCHEMBL7307232 0.88 LMNA (0.44) LMNACHRM1AURKACYP3A4DRD3
SCHEMBL7320493 0.87 OPRK1 (0.46) LMNACHRM1OPRK1PDE4DKCNH2
SCHEMBL7319570 0.87 OPRK1 (0.46) LMNACHRM1OPRK1PDE4DKCNH2
SCHEMBL11371073 0.86 LMNA (0.42) LMNACHRM1CYP3A4DRD3OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1085870-A2 MULTIVALENT AGONISTS, PARTIAL AGONISTS AND ANTAGONISTS OF THE GABA RECEPTORS Advanced Medicine, Inc. (US) 2001-03-28 EP disclosed
WO-1999063933-A9 MULTIVALENT AGONISTS, PARTIAL AGONISTS AND ANTAGONISTS OF THE GABA RECEPTORS ADVANCED MEDICINE INC (US) 2000-04-27 WO disclosed
WO-1999063933-A2 MULTIVALENT AGONISTS, PARTIAL AGONISTS AND ANTAGONISTS OF THE GABA RECEPTORS ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed
US-4440685-A MUSCLE RELAXANTS, SEDATIVES, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1984-04-03 US disclosed
US-4425272-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1984-01-10 US disclosed
US-4401597-A INTERMEDIATES FOR ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVE AND ANXIOLYTICS HOFFMANN-LA ROCHE INC. (US) 1983-08-30 US disclosed
US-4390471-A INTERMEDIATES FOR IMIDOBENZODIAZEPINE AND ANALOGS HOFFMANN-LA ROCHE INC. (US) 1983-06-28 US disclosed
US-4377523-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1983-03-22 US disclosed
US-4376075-A REACTION OF AN AMINODERIVATIVE THEREOF WITH AN ALDEHYDE HOFFMANN-LA ROCHE INC. (US) 1983-03-08 US disclosed
US-4376074-A ANTICONVULSANTS, MUSCLE RELAXANTS AND SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1983-03-08 US disclosed
US-4349477-A IMIPAZO/1,5-A//1,4/BENZO-, THIENO- OR PYRAZOLODIAZEPINES FROM 2-DIMORPHOLINOPHOSPHONATES OF BENZO-, THIENO- OR PYRAZOLODIAZEPINES HOFFMANN-LA ROCHE INC. (US) 1982-09-14 US disclosed
US-4347365-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4347364-A INTERMEDIATES THEREFOR HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4307237-A ANTICONVULSANTS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1981-12-22 US disclosed
US-4280957-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1981-07-28 US disclosed
US-4238610-A Intermediates for the production of imidazobenzodiazepines HOFFMANN-LA ROCHE INC. (US) 1980-12-09 US disclosed
US-4166185-A ANTICONVULSANTS, ANXIOLYTICS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1979-08-28 US disclosed
US-4147875-A ANTIDEPRESSANTS, ANTICONBULSANTS, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1979-04-03 US disclosed
US-4146722-A SEDATIVES, MUSCLE RELAXANTS, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1979-03-27 US disclosed
US-4125726-A SEDATIVES, MUSCLE RELAXANTS, ANXIOLYTICS, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1978-11-14 US disclosed