SCHEMBL7142836

SCHEMBL7142836

Cc1cccc2c1C(=O)N(C)CC(=O)N2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GRIA1 P42261 1/20 0.43
CACNG8 Q8WXS5 1/20 0.43
CRBN Q96SW2 2/20 0.41
CREBBP Q92793 3/20 0.41
PARP1 P09874 1/20 0.41
DDB1 Q16531 1/20 0.41
BRD4 O60885 2/20 0.40
ROCK2 O75116 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PDPK1 O15530 1/20 0.38
KDR P35968 1/20 0.38
HSD17B10 Q99714 2/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
RET P07949 2/20 0.37
ERBB2 P04626 2/20 0.37

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
SCHEMBL4047908 0.83 CES1 (0.47) MEN1KMT2ACRBNCREBBPPARP1
SCHEMBL11193913 0.83 KMT2A (0.46) MEN1KMT2ACRBNCREBBPPARP1
SCHEMBL7269697 0.83 KMT2A (0.46) MEN1KMT2ACRBNCREBBPPARP1
SCHEMBL9715259 0.83 KMT2A (0.52) MEN1KMT2ACRBNCREBBPPARP1
SCHEMBL10627797 0.80 MEN1 (0.43) MEN1KMT2ACRBNCREBBPBRD4
SCHEMBL31170855 0.80 CRBN (0.44) MEN1KMT2AGRIA1CACNG8CRBN
SCHEMBL10654157 0.79 MEN1 (0.43) MEN1KMT2ACRBNCREBBPPARP1
SCHEMBL10627763 0.79 MEN1 (0.43) MEN1KMT2ACRBNCREBBPBRD4
SCHEMBL10964115 0.78 DDB1 (0.42) MEN1KMT2ACRBNDDB1LMNA
SCHEMBL10365346 0.76 PARP1 (0.44) MEN1KMT2ACRBNPARP1DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202977-B1 PROCESS FOR MANUFACTURING DIAZEPINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2003-12-17 EP disclosed
EP-1202977-A2 PROCESS FOR MANUFACTURING DIAZEPINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-05-08 EP disclosed
US-6281353-B1 EXPANSION WITH AN AMINECARBOXY COMPOUND THE CORRESPONDING3,1-BENZOXAZIN-2,4-DIONE COMPOUND HOFFMANN-LA ROCHE INC. 2001-08-28 US disclosed
WO-2000069835-A2 PROCESS FOR MANUFACTURING DIAZEPINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-11-23 WO disclosed
US-4772696-A CYCLIZATION USING ISONITRILE A/S FERROSAN (DK) 1988-09-20 US disclosed
US-4745112-A CENTRAL NERVOUS SYSTEM DISORDERS, ANXIETY ANTICONVULSANTS A/S FERROSAN (DK) 1988-05-17 US disclosed
US-4727153-A NERVOUS SYSTEM DISORDERS A/S FERROSAN (DK) 1988-02-23 US disclosed
US-4670433-A CARDIOVASCULAR DISORDERS A/S FERROSAN (DK) 1987-06-02 US disclosed
EP-0197282-A1 Novel oxadiazolyl imidazobenzodiazepine derivatives and methods of preparing such compounds A/S FERROSAN (DK) 1986-10-15 EP disclosed
US-4363762-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-12-14 US disclosed
US-4359420-A HYPOTENSIVE AGENT, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1982-11-16 US disclosed
US-4346032-A ANTIDOTES TO OVERDOSES OF BENZODIAZEPINE TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346034-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346031-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346030-A ANTIDOTES FOR OVERDOSES OF BENZODIAZEPINE TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346035-A Process for preparing imidazodiazepines HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346036-A ALKYLATION; AMIDATION; TRANQUILIZER ANTAGONIST HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4346033-A Thienodiazepinone and benzodiazepinone intermediates HOFFMANN-LA ROCHE INC. (US) 1982-08-24 US disclosed
US-4316839-A Imidazodiazepine derivatives HOFFMAN-LA ROCHE INC. (US) 1982-02-23 US disclosed
EP-0027214-A1 Imidazodiazepine derivatives, process and intermediates for their preparation, medicaments containing them and their therapeutic application F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1981-04-22 EP disclosed