SCHEMBL1386080

SCHEMBL1386080

O=C(O)OC1Cc2ccccc2N1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.57
MAPT P10636 1/20 0.57
EPHX2 P34913 1/20 0.38
BRD4 O60885 1/20 0.37
CREBBP Q92793 1/20 0.37
MTNR1A P48039 3/20 0.36
MTNR1B P49286 1/20 0.36
AR P10275 1/20 0.36
ALDH1A1 P00352 1/20 0.35
FABP7 O15540 1/20 0.35
FABP5 Q01469 1/20 0.35
SMYD3 Q9H7B4 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 1/20 0.32
DYRK1A Q13627 1/20 0.32

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
SCHEMBL5688782 1.00 GAA (0.57) GAAMAPTEPHX2BRD4CREBBP
SCHEMBL5688979 1.00 GAA (0.57) GAAMAPTEPHX2BRD4CREBBP
Hydrochloric Acid SCHEMBL7313114 0.98 GAA (0.56) GAAMAPTEPHX2BRD4CREBBP
SCHEMBL9408124 0.90 GAA (0.48) GAAMAPT
SCHEMBL27477039 0.85 GAA (0.51) GAAMAPTEPHX2BRD4CREBBP
SCHEMBL8120364 0.85 GAA (0.51) GAAMAPTEPHX2BRD4CREBBP
SCHEMBL6211215 0.83 MAPT (0.46) GAAMAPTMTNR1AMTNR1BALDH1A1
SCHEMBL2487417 0.82 GAA (0.49) GAAMAPTEPHX2BRD4CREBBP
SCHEMBL8444853 0.82 GAA (0.49) GAAMAPTEPHX2BRD4CREBBP
SCHEMBL27604666 0.80 GAA (0.46) GAAMAPTEPHX2BRD4CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4800482-B2 2011-10-26 JP claimed
EP-1833789-B1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED INDOLINE-2-CARBOXYLIC ACID DSM IP ASSETS BV (NL) 2011-07-06 EP claimed
EP-1294689-B1 PREPARATION METHOD OF A NOVEL BETA CRYSTALLINE FORM OF PERINDOPRIL TERT-BUTYLAMINE SALT SERVIER LAB (FR) 2006-04-26 EP claimed
EP-1348684-B1 Method for synthesis of (2S)-indoline-2-carboxylic acid; and use in the synthesis of perindopril SERVIER LAB (FR) 2006-03-08 EP claimed
EP-0937714-B1 Process for the preparation of an optically active indoline-2-carboxylic acid or derivative thereof DSM IP ASSETS BV (NL) 2004-10-06 EP claimed
EP-1140826-A1 METHOD FOR PRODUCING (2S,4R,9S)-OCTAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID AND INTERMEDIATE PRODUCTS THEREFOR BASF AKTIENGESELLSCHAFT (DE) 2001-10-10 EP claimed
WO-2000040555-A1 METHOD FOR PRODUCING (2S,4R,9S)-OCTAHYDRO-1H-INDOLE-2-CARBOXYLIC ACID AND INTERMEDIATE PRODUCTS THEREFOR BASF AKTIENGESELLSCHAFT (DE) 2000-07-13 WO claimed
EP-0793674-B1 HUMAN NEUTROPHIL ELASTASE INHIBITORS CORTECH INC (US) 2000-05-24 EP claimed
EP-0920307-A2 DERIVATES FROM BISARYLTETRACARBONACID, AND PHARMARCEUTICAL PRODUCT CONTAINING THEM Roche Diagnostics GmbH (DE) 1999-06-09 EP claimed
WO-1998006386-A2 DERIVATES FROM BISARYLTETRACARBONACID, AND PHARMARCEUTICAL PRODUCT CONTAINING THEM ROCHE DIAGNOSTICS GMBH (DE) 1998-02-19 WO claimed
EP-0521827-B1 Pharmacological active hydrazin derivatives and process for their preparation CIBA GEIGY AG (CH) 1996-09-25 EP claimed
EP-0604368-B1 Anti retroviral hydrazine derivatives CIBA GEIGY AG (CH) 1996-09-18 EP claimed
EP-0604368-A1 Anti retroviral hydrazine derivatives CIBA-GEIGY AG (CH) 1994-06-29 EP claimed
EP-0521827-A1 Pharmacological active hydrazin derivatives and process for their preparation CIBA-GEIGY AG (CH) 1993-01-07 EP claimed
EP-0197474-B1 PROCESS FOR PREPARING OPTICALLY ACTIVE INDOLINE-2-CARBOXYLIC ACID KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-07-10 EP claimed
EP-0236734-A2 5-Amino-4-hydroxyvaleryl derivatives substituted by s-containing groups CIBA-GEIGY AG (CH) 1987-09-16 EP claimed
EP-0184550-A2 5-Amino-4-hydroxy valeryl amide derivatives CIBA-GEIGY AG (CH) 1986-06-11 EP claimed
EP-2225223-B1 ORGANIC COMPOUNDS BOEHRINGER INGELHEIM INT (DE) 2017-01-11 EP disclosed
EP-0029488-A1 Amino acid derivatives, process for their preparation and their use in treating hypertension HOECHST AKTIENGESELLSCHAFT (DE) 1981-06-03 EP disclosed
EP-0001546-A1 2-Guanidinomethyl-indolines, method for their preparation and their pharmaceutical use Merck Patent GmbH (DE) 1979-05-02 EP disclosed