SCHEMBL4421929

SCHEMBL4421929

CC(C)(Cl)C(=O)c1ccc(C(=O)c2ccc(C(=O)C(C)(C)Cl)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
LMNA P02545 2/20 0.48
SRD5A2 P31213 4/20 0.47
ELANE P08246 5/20 0.45
HPGD P15428 4/20 0.44
MAPT P10636 2/20 0.44
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
PKM P14618 1/20 0.44
HTT P42858 1/20 0.44
FABP2 P12104 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
SLC22A12 Q96S37 1/20 0.42
MAPK1 P28482 1/20 0.41
SIRT1 Q96EB6 1/20 0.41

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
SCHEMBL10949219 0.92 ALDH1A1 (0.56) ALDH1A1LMNASRD5A2ELANEHPGD
SCHEMBL10710376 0.84 CA2 (0.53) ALDH1A1LMNASRD5A2HPGDMAPT
SCHEMBL10887646 0.84 CES2 (0.52) ALDH1A1LMNASRD5A2ELANEHPGD
SCHEMBL17338720 0.82 HDAC1 (0.41) ALDH1A1SRD5A2MAPTHTTSIRT1
SCHEMBL10714051 0.82 HDAC1 (0.55) ALDH1A1LMNASRD5A2MAPTHTT
SCHEMBL29043915 0.82 CES2 (0.50) MAPTHTTMAPK1
SCHEMBL1445897 0.81 CES1 (0.54) ALDH1A1HPGDMAPTMAPK1
SCHEMBL480674 0.80 KMT2A (0.54) ALDH1A1LMNASRD5A2ELANE
SCHEMBL3682129 0.80 PLK1 (0.40) ALDH1A1
SCHEMBL1446151 0.80 HPGD (0.54) ALDH1A1SRD5A2ELANEHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1784429-B Novel trifunctional photoinitiators CIBA SC HOLDING AG 2010-06-02 CN disclosed
EP-1620475-B1 NOVEL TRIFUNCTIONAL PHOTOINITIATORS BASF SE (DE) 2009-11-11 EP disclosed
US-7462650-B2 Trifunctional photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-12-09 US disclosed
US-20060270748-A1 Novel trifunctional photoinitiators IGM GROUP B.V. (NL) 2006-11-30 US disclosed
CN-1784429-A Novel trifunctional photoinitiators CIBA SC HOLDING AG (CH) 2006-06-07 CN disclosed
EP-1620475-A1 NOVEL TRIFUNCTIONAL PHOTOINITIATORS Ciba SC Holding AG (CH) 2006-02-01 EP disclosed
WO-2004099262-A1 NOVEL TRIFUNCTIONAL PHOTOINITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-11-18 WO disclosed
US-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 US disclosed