SCHEMBL1387747

SCHEMBL1387747

N#CC1=C(Cl)C(=O)C(=O)C(Cl)=C1C#N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.44
BCHE P06276 2/20 0.44
ACHE P22303 2/20 0.44
CES1 P23141 2/20 0.44
NSD2 O96028 1/20 0.44
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
CYP3A4 P08684 2/20 0.39
MAPT P10636 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
RECQL P46063 1/20 0.39
HIF1A Q16665 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL244289 0.85 CES2 (0.44) CES2BCHEACHECES1NSD2
SCHEMBL2952 0.81 MEN1 (0.47) CES2BCHEACHECES1NSD2
Water SCHEMBL28189365 0.81 MEN1 (0.47) CES2BCHEACHECES1NSD2
SCHEMBL12500062 0.81 MEN1 (0.39) CES2BCHEACHECES1NSD2
SCHEMBL375015 0.81 MEN1 (0.47) CES2BCHEACHECES1NSD2
SCHEMBL383049 0.80 CES2 (0.45) CES2BCHEACHECES1NSD2
SCHEMBL28071586 0.79 CES2 (0.44) CES2BCHEACHECES1NSD2
Hydrochloric Acid SCHEMBL8130707 0.79 CES2 (0.44) CES2BCHEACHECES1NSD2
SCHEMBL9196667 0.77 CES2 (0.42) CES2BCHEACHECES1NSD2
SCHEMBL12954420 0.76 KDM4E (0.30) CES2BCHEACHECES1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614126-B1 Process for making a photoresist pattern and photoresist composition containing an oxidising compound FRANCE TELECOM (FR) 2002-02-06 EP claimed
EP-0694032-B1 METHOD FOR PREPARING BETA-LACTAMS AVENTIS PHARMA SA (FR) 2000-07-26 EP claimed
JP-H08508748-A 1996-09-17 JP claimed
EP-0694032-A1 METHOD FOR PREPARING $g(b)-LACTAMS Aventis Pharma S.A. (FR) 1996-01-31 EP claimed
WO-1994024103-A1 METHOD FOR PREPARING β-LACTAMS RHONE-POULENC RORER S.A. (FR) 1994-10-27 WO claimed
EP-0614126-A1 Process for making a photoresist pattern and photoresist composition containing an oxidising compound FRANCE TELECOM (FR) 1994-09-07 EP claimed
EP-0095340-B1 PROCESSES FOR MAKING 3-METHYLTHIOPHENE-2-CARBOXALDEHYDE AND INTERMEDIATES THEREFOR PFIZER INC. (US) 1986-08-13 EP claimed
EP-0019690-B1 6-BETA.7-BETA; 15.16-DIMETHYLENE-1,4-ANDROSTADIENE-3-ONES, PROCESS FOR THEIR PREPARATION AND THEIR UTILIZATION IN MEDICINES SCHERING AKTIENGESELLSCHAFT (DE) 1982-04-21 EP claimed
EP-0614126-B1 Process for making a photoresist pattern and photoresist composition containing an oxidising compound FRANCE TELECOM (FR) 2002-02-06 EP disclosed
EP-0694032-B1 METHOD FOR PREPARING BETA-LACTAMS AVENTIS PHARMA SA (FR) 2000-07-26 EP disclosed
EP-0432040-B2 Heterocyclic derivatives of acylaminothiazole, their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1997-12-17 EP disclosed
EP-0694032-A1 METHOD FOR PREPARING $g(b)-LACTAMS Aventis Pharma S.A. (FR) 1996-01-31 EP disclosed
EP-0625148-A1 NOVEL BACCATINE III AND 10-DEACETYL BACCATINE III DERIVATIVES, THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Aventis Pharma S.A. (FR) 1994-11-23 EP disclosed
WO-1994024103-A1 METHOD FOR PREPARING β-LACTAMS RHONE-POULENC RORER S.A. (FR) 1994-10-27 WO disclosed
EP-0614126-A1 Process for making a photoresist pattern and photoresist composition containing an oxidising compound FRANCE TELECOM (FR) 1994-09-07 EP disclosed
EP-0595990-A1 NOVEL 6-SUBSTITUTED STEROIDS, METHODS FOR PRODUCING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID STEROIDS LABORATOIRE THERAMEX S.A. (MC) 1994-05-11 EP disclosed
WO-1993016060-A1 NOVEL BACCATINE III AND 10-DEACETYL BACCATINE III DERIVATIVES, THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1993-08-19 WO disclosed
WO-1993002095-A1 NOVEL 6-SUBSTITUTED STEROIDS, METHODS FOR PRODUCING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID STEROIDS LABORATOIRE THERAMEX S.A. (MC) 1993-02-04 WO disclosed
EP-0432040-A1 Heterocyclic derivatives of acylaminothiazole, their preparation and pharmaceutical compositions containing them SANOFI (FR) 1991-06-12 EP disclosed