SCHEMBL2454097

SCHEMBL2454097

O=C(O)C(Cl)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 4/20 0.47
CYP2C19 P33261 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
CYP2D6 P10635 2/20 0.47
HSD17B10 Q99714 2/20 0.47
BRD4 O60885 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
TSHR P16473 3/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GABBR2 O75899 3/20 0.46
GABBR1 Q9UBS5 3/20 0.46
LMNA P02545 2/20 0.46
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.46

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
SCHEMBL11831089 0.94 FFAR1 (0.46) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL11336506 0.81 BRD4 (0.47) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL3739027 0.81 SRC (0.50) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL664900 0.80 SRC (0.56) KMT2AMEN1CYP2D6HSD17B10HDAC4
SCHEMBL5325296 0.80 SRC (0.56) KMT2AMEN1CYP2D6HSD17B10HDAC4
SCHEMBL3383072 0.79 LMNA (0.46) KMT2AMEN1LMNAPOLBCES2
SCHEMBL3993817 0.79 BRD4 (0.61) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL11307633 0.79 LDHA (0.45) CYP2C19KMT2AMEN1CYP1A2CES2
SCHEMBL3070290 0.79 HDAC3 (0.45) HDAC4HDAC7HDAC5LMNACES2
SCHEMBL5441902 0.79 BRD4 (0.45) CYP2C9CYP2C19KMT2AMEN1CYP2D6

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-102603508-B Preparation method of 1-(4-chlorophenyl)-2-cyclopropyl-1-acetone and intermediate thereof as well as preparation method of intermediate JIANGSU CHENGYANG CROP TECHNOLOGY CO LTD 2014-03-12 CN disclosed
EP-1853583-B1 AMINE-LINKED PYRIDYL AND PHENYL SUBSTITUTED PIPERAZINE-PIPERIDINES WITH CXCR3 ANTAGONIST ACTIVITY SCHERING CORP (US) 2011-09-07 EP disclosed
EP-1456254-B1 SUPPORTED TITANIUM-CONTAINING CATALYST FOR HOMO-, CO-, AND TER-POLYMERIZATION OF OLEFINS POLIMERI EUROPA SPA (IT) 2010-03-24 EP disclosed
US-7449528-B2 Supported catalyst containing active titanium in the homo, co-, and ter-polymerization of olefin-unsaturated compounds POLIMERI EUROPA S.P.A. (IT) 2008-11-11 US disclosed
US-20060014631-A1 Supported catalyst containing active titanium in the homo, co-, and ter-polymerization of olefin-unsaturated compounds POLIMERI EUROPA S.P.A. (IT) 2006-01-19 US disclosed
EP-1456254-A2 SUPPORTED TITANIUM-CONTAINING CATALYST FOR HOMO-, CO-, AND TER-POLYMERIZATION OF OLEFINS Polimeri Europa S.p.A. (IT) 2004-09-15 EP disclosed
WO-2003054034-A2 SUPPORTED TITANIUM-CONTAINING FOR HOMO-, CO-, AND TER-POLYMERIZATION OF OLEFINS POLIMERI EUROPA S.P.A. (IT) 2003-07-03 WO disclosed
US-4627874-A RICE PRODUCTION IDEMITSU KOSAN COMPANY LIMITED (JP) 1986-12-09 US disclosed
US-4455164-A HALOGENATED DERIVATIVES IDEMITSU KOSAN COMPANY LIMITED (JP) 1984-06-19 US disclosed