SCHEMBL6623124

SCHEMBL6623124

O=c1cc2ccc3nncccc3c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
DHODH Q02127 1/20 0.33
KDM4E B2RXH2 3/20 0.32
TYMS P04818 2/20 0.32
NQO2 P16083 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL4464552 0.72 MAPT (0.50) KMT2AMEN1KDM4ECYP3A4LMNA
SCHEMBL9983598 0.71 PKM (0.33)
SCHEMBL6998636 0.71 TYMS (0.35) KMT2AMEN1TYMSLMNA
SCHEMBL29694275 0.69 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1USP2HPGD
SCHEMBL2811653 0.69 PKM (0.31)
SCHEMBL496870 0.68 MAPKAPK2 (0.36) ALDH1A1KMT2AMEN1HPGDHSD17B10
SCHEMBL30538321 0.67 MAPT (0.52) ALDH1A1KMT2AMEN1HSD17B10KDM4E
SCHEMBL18839387 0.67 PDE3B (0.34) KMT2AMEN1
SCHEMBL7368978 0.65 LMNA (0.61) ALDH1A1KMT2AMEN1USP2NOS3
SCHEMBL7364735 0.65 LMNA (0.40) ALDH1A1KMT2AMEN1HSD17B10DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1196418-B1 METHOD FOR PREPARING SUBSTITUTED 1,4]DIAZEPINO 6,7,1- i hi /i ]INDOL-4-ONES WARNER LAMBERT CO (US) 2004-06-16 EP claimed
EP-1196418-A1 METHOD FOR PREPARING SUBSTITUTED 1,4]DIAZEPINO 6,7,1- i hi /i ]INDOL-4-ONES WARNER-LAMBERT COMPANY (US) 2002-04-17 EP claimed
WO-2001002403-A1 METHOD FOR PREPARING SUBSTITUTED [1,4]DIAZEPINO[6,7,1-hi]INDOL-4-ONES WARNER-LAMBERT COMPANY (US) 2001-01-11 WO claimed
CN-1166668-C Method for preparing substituted [1,4] diazepino (6,7,1-hi) indol-4-ones ��ʲ 2004-09-15 CN disclosed
EP-1196418-B1 METHOD FOR PREPARING SUBSTITUTED 1,4]DIAZEPINO 6,7,1- i hi /i ]INDOL-4-ONES WARNER LAMBERT CO (US) 2004-06-16 EP disclosed
EP-1196418-B1 METHOD FOR PREPARING SUBSTITUTED 1,4]DIAZEPINO 6,7,1- i hi /i ]INDOL-4-ONES WARNER LAMBERT CO (US) 2004-06-16 EP disclosed
US-6689881-B1 Method for preparing substituted [1,4]diazepino[6,7,1-hi]indol-4-ones WARNER-LAMBERT LLC 2004-02-10 US disclosed
US-6689881-B1 Method for preparing substituted [1,4]diazepino[6,7,1-hi]indol-4-ones WARNER-LAMBERT LLC 2004-02-10 US disclosed
US-20020119967-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of IL-12-production WARNER-LAMBERT COMPANY 2002-08-29 US disclosed
CN-1362960-A Process for the preparation of substituted [1,4] -diaza * o [6,7, 1-hi ] -indol-4-ones WARNER LAMBERT CO (US) 2002-08-07 CN disclosed
WO-2002022112-A9 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING A DISEASE ASSOCIATED WITH AN EXCESS OF IL-12 PRODUCTION WARNER LAMBERT CO (US) 2002-06-06 WO disclosed
EP-1199074-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of il-12 production WARNER-LAMBERT COMPANY (US) 2002-04-24 EP disclosed
EP-1196418-A1 METHOD FOR PREPARING SUBSTITUTED 1,4]DIAZEPINO 6,7,1- i hi /i ]INDOL-4-ONES WARNER-LAMBERT COMPANY (US) 2002-04-17 EP disclosed
EP-1196418-A1 METHOD FOR PREPARING SUBSTITUTED 1,4]DIAZEPINO 6,7,1- i hi /i ]INDOL-4-ONES WARNER-LAMBERT COMPANY (US) 2002-04-17 EP disclosed
EP-1188438-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of Il-12 production WARNER-LAMBERT COMPANY (US) 2002-03-20 EP disclosed
WO-2001002403-A1 METHOD FOR PREPARING SUBSTITUTED [1,4]DIAZEPINO[6,7,1-hi]INDOL-4-ONES WARNER-LAMBERT COMPANY (US) 2001-01-11 WO disclosed
WO-2001002403-A1 METHOD FOR PREPARING SUBSTITUTED [1,4]DIAZEPINO[6,7,1-hi]INDOL-4-ONES WARNER-LAMBERT COMPANY (US) 2001-01-11 WO disclosed