SCHEMBL2456548

SCHEMBL2456548

O=C(O)CC(Cl)(C(=O)O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.54
HIF1A Q16665 3/20 0.53
CYP2C19 P33261 1/20 0.53
MIF P14174 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 3/20 0.40
SLC13A5 Q86YT5 2/20 0.38
CYP2D6 P10635 1/20 0.37
AKR1B1 P15121 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
KCNN4 O15554 1/20 0.35
CYP2C9 P11712 1/20 0.35
KEAP1 Q14145 2/20 0.35
NFE2L2 Q16236 1/20 0.35
TRPA1 O75762 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL3384635 0.81 CYP1A2 (0.56) CYP1A2HIF1ACYP2C19TSHRALDH1A1
SCHEMBL3433832 0.79 CYP1A2 (0.54) CYP1A2HIF1ACYP2C19TSHRALDH1A1
SCHEMBL15125011 0.79 CYP1A2 (0.54) CYP1A2HIF1ACYP2C19TSHRALDH1A1
SCHEMBL15228092 0.79 CYP1A2 (0.54) CYP1A2HIF1ACYP2C19TSHRALDH1A1
SCHEMBL6548609 0.78 HIF1A (0.57) CYP1A2HIF1ACYP2C19MIFTSHR
SCHEMBL28689277 0.78 CYP1A2 (0.52) CYP1A2HIF1ACYP2C19TSHRALDH1A1
SCHEMBL11637439 0.77 TDP1 (0.44) CYP1A2CYP2C19TSHRALDH1A1MAPT
SCHEMBL15125012 0.77 HIF1A (0.55) CYP1A2HIF1ACYP2C19MIFTSHR
SCHEMBL5925077 0.76 CYP1A2 (0.50) CYP1A2HIF1ACYP2C19TSHRALDH1A1
SCHEMBL27466589 0.76 CYP1A2 (0.50) CYP1A2HIF1ACYP2C19TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101289387-A 6-chlor-2,3-dihydro- indene-3-ketone-1-carboxyl acid optical isomer and method for preparing same UNIV CHINA PHARMA (CN) 2008-10-22 CN claimed
EP-4323415-A1 PREPOLYMERIZED CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2024-02-21 EP disclosed
CN-116648230-A Composition for caring skin 莱雅公司 2023-08-25 CN disclosed
EP-2542592-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.R.L. (IT) 2013-01-09 EP disclosed
CN-102040556-B Optical isomer of indene quinolone, preparation method and medical application thereof YANGTZE RIVER PHARM GROUP CO 2012-05-23 CN disclosed
WO-2011107371-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2011-09-09 WO disclosed
CN-102040556-A Optical isomers of indene quinazoline, preparation method and medicinal application thereof YANGTZE RIVER PHARM GROUP CO 2011-05-04 CN disclosed
CN-101289387-A 6-chlor-2,3-dihydro- indene-3-ketone-1-carboxyl acid optical isomer and method for preparing same UNIV CHINA PHARMA (CN) 2008-10-22 CN disclosed
EP-1525231-A1 CATALYST SYSTEM FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.P.A. (IT) 2005-04-27 EP disclosed
WO-2004005359-A1 CATALYST SYSTEM FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2004-01-15 WO disclosed
EP-1088009-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Basell Technology Company B.V. (NL) 2001-04-04 EP disclosed
WO-2000063261-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL TECHNOLOGY COMPANY B.V. (NL) 2000-10-26 WO disclosed