SCHEMBL6578871

SCHEMBL6578871

CC(C)(c1c(Cl)cccc1Cl)c1c(Cl)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.43
CYP2A6 P11509 2/20 0.43
TSHR P16473 3/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 4/20 0.39
POLB P06746 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
PNMT P11086 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
NFKB1 P19838 1/20 0.34
MAPK1 P28482 1/20 0.34
PDK1 Q15118 1/20 0.34
PDK2 Q15119 1/20 0.34
PDK3 Q15120 1/20 0.34
PDK4 Q16654 1/20 0.34
TAAR1 Q96RJ0 1/20 0.33
NR4A2 P43354 1/20 0.33

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
SCHEMBL78160 0.82 CYP1A2 (0.43) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL17972846 0.78 ALDH1A1 (0.41) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL21718387 0.78 CYP1A2 (0.39) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL18242921 0.78 CYP1A2 (0.39) CYP1A2CYP2A6TSHRLMNAALDH1A1
1,2-Dichlorobenzene SCHEMBL29236100 0.75 TSHR (0.67) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL7932263 0.75 CYP1A2 (0.47) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL803041 0.74 GABRA1 (0.40) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL19222035 0.74 LMNA (0.39) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL15132131 0.74 CA2 (0.46) CYP1A2CYP2A6TSHRLMNAALDH1A1
SCHEMBL8233490 0.72 TAAR1 (0.46) CYP1A2CYP2A6TSHRLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1044227-B1 PARTIALLY POLYMERIZED MIXTURE OF DIETHYLENE GLYCOL (ALLYL CARBONATE) COMPOUNDS PPG IND OHIO INC (US) 2004-04-28 EP disclosed
EP-1044228-B1 PROCESS FOR FORMING POLY(ALLYL CARBONATE)-FUNCTIONAL PREPOLYMER COMPOSITION PPG IND OHIO INC (US) 2002-07-10 EP disclosed
US-6057411-A HEATING ALLYL CARBONATE WITH FREE RADICAL INITIATOR FOR POLYMERIZATION PPG INDUSTRIES OHIO, INC. (US) 2000-05-02 US disclosed
US-5952441-A LOW SHRINKAGE IN THE MOLD BY ADDING A PREPOLYMER COMPRISING PARTIAL POLYMERIZED ETHYLENIC DOUBLE BONDS PPG INDUSTRIES OHIO, INC. (US) 1999-09-14 US disclosed
US-5196531-A Poly(N-cyclic iminoether), process for production thereof, thermosetting composition containing it and thermoset resin TEIJIN LIMITED (JP) 1993-03-23 US disclosed
US-5189094-A Reacting a poly(cyclic iminoether), and ethylenically unsaturated compounds TEIJIN LIMITED (JP) 1993-02-23 US disclosed
EP-0351814-A2 Poly (N-cyclic iminoether), processes for production thereof, thermosetting composition containing it and thermoset resin TEIJIN LIMITED (JP) 1990-01-24 EP disclosed
EP-0336390-A2 Process for producing thermoset resin TEIJIN LIMITED (JP) 1989-10-11 EP disclosed