SCHEMBL5327486

SCHEMBL5327486

CCc1ccc2c(c1)NC(=O)C2=O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.63
MAOB P27338 8/20 0.63
CES1 P23141 6/20 0.55
TGM2 P21980 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
ALDH1A1 P00352 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PARP1 P09874 1/20 0.45
BCHE P06276 1/20 0.43

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
SCHEMBL4201784 0.86 MAOB (0.69) MAOAMAOBCES1TGM2ALDH1A1
SCHEMBL2246979 0.85 TGM2 (0.73) MAOAMAOBCES1TGM2SMN1; SMN2
SCHEMBL12124081 0.82 SMN1; SMN2 (0.47) MAOAMAOBCES1TGM2SMN1; SMN2
SCHEMBL11702086 0.82 ALDH1A1 (0.47) MAOAMAOBCES1TGM2SMN1; SMN2
SCHEMBL23806091 0.81 SMN1; SMN2 (0.59) MAOAMAOBTGM2SMN1; SMN2ALDH1A1
SCHEMBL13375281 0.81 MAOA (0.63) MAOAMAOBCES1TGM2BCHE
SCHEMBL22794312 0.81 ALDH1A1 (0.59) MAOAMAOBTGM2SMN1; SMN2ALDH1A1
SCHEMBL19642904 0.81 MAOB (0.63) MAOAMAOBCES1TGM2BCHE
SCHEMBL13594800 0.81 MAOA (0.58) MAOAMAOBCES1TGM2ALDH1A1
SCHEMBL12470147 0.81 MAOA (0.58) MAOAMAOBCES1TGM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105732460-A Method for synthesizing indole compound 常州工程职业技术学院 2016-07-06 CN claimed
CN-102690226-A Multi-nitrogen substituted isatin derivative and synthetic method of multi-nitrogen substituted isatin derivative UNIV GUANGDONG TECHNOLOGY 2012-09-26 CN claimed
CN-105732476-B A kind of carbazole isatin type compound and its preparation method and purposes 吉首大学 2017-12-01 CN disclosed
CN-105732476-A Carbazole-isatin type compound and preparation method and application thereof 吉首大学 2016-07-06 CN disclosed
CN-105732460-A Method for synthesizing indole compound 常州工程职业技术学院 2016-07-06 CN disclosed
CN-102924448-B Alkaloid cryptolepine analogue quindoline acid compound and preparation method UNIV BOHAI 2015-02-25 CN disclosed
CN-102924448-A Alkaloid cryptolepine analogue quindoline acid compound and preparation method UNIV BOHAI 2013-02-13 CN disclosed
CN-102690226-A Multi-nitrogen substituted isatin derivative and synthetic method of multi-nitrogen substituted isatin derivative UNIV GUANGDONG TECHNOLOGY 2012-09-26 CN disclosed
WO-2011054874-A1 METHOD FOR THE PREPARATION OF 2-AMINO-6-ETHYLBENZOIC ACID ACTIVE BIOTECH AB (SE) 2011-05-12 WO disclosed
EP-2316818-A1 Method for the preparation of 2-amino-6-ethylbenzoic acid Active Biotech AB (SE) 2011-05-04 EP disclosed
WO-2007132280-A1 ISATIN AND ITS DERIVATIVES FOR USE AS A MEDICAMENT Szegedi Tudományegyetem (HU) 2007-11-22 WO disclosed
WO-1995020581-A1 NOVEL HUMAN LEUKOCYTE ELASTASE (HLE) INHIBITORS, AND RELATED PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE SRI INTERNATIONAL (US) 1995-08-03 WO disclosed
US-5428021-A Administering to inhibit serine proteases SRI INTERNATIONAL (US) 1995-06-27 US disclosed
EP-0147211-B1 4H-3,1-BENZOXAZIN-4-ONES AND RELATED COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION SYNTEX (U.S.A.) INC. (US) 1990-09-12 EP disclosed
US-4873232-A ARTHRITIS AND AUTOIMMUNE DISEASES SYNTEX (US) 1989-10-10 US disclosed
US-4745116-A INHIBITORS OF SERINE PROTEASE SYNTEX (U.S.A.) INC. (US) 1988-05-17 US disclosed
US-4665070-A SERINE PROTEINASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1987-05-12 US disclosed
US-4657893-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1987-04-14 US disclosed
EP-0206323-A1 2-Oxy-4H-3,1-benzoxazin-4-one derivatives and related compounds SYNTEX (U.S.A.) INC. (US) 1986-12-30 EP disclosed
EP-0147211-A2 4H-3,1-benzoxazin-4-ones and related compounds, pharmaceutical compositions containing them, and processes for their preparation SYNTEX (U.S.A.) INC. (US) 1985-07-03 EP disclosed