SCHEMBL7556014

SCHEMBL7556014

CC(C)(c1c(Br)cccc1Br)c1c(Br)cccc1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ CA2 P00918 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ ALOX12 P18054 2/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA6 P23280 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ RIPK1 Q13546 1/20 0.32
▸ PLCG1 P19174 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ MAPK1 P28482 3/20 0.31
▸ GABRA1 P14867 1/20 0.31

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
SCHEMBL14918216 0.82 ALDH1A1 (0.39) ALDH1A1CA2CA1CA4CA6
SCHEMBL18242852 0.78 ALDH1A1 (0.36) ALDH1A1CA2CA1CA4CA6
SCHEMBL21718404 0.74 GABRA1 (0.52) TSHRHSD17B10RIPK1PLCG1GABRA1
SCHEMBL9321209 0.74 ALDH1A1 (0.50) ALDH1A1CA2CA1CA4CA6
SCHEMBL20508228 0.74 RIPK1 (0.36) ALDH1A1TSHRRIPK1PLCG1GABRA1
SCHEMBL9323507 0.73 MEN1 (0.41) ALDH1A1CA2CA1HPGDTSHR
SCHEMBL21718766 0.72 ALDH1A1 (0.32) ALDH1A1CA2AHR
SCHEMBL21718835 0.72 CYP1A2 (0.35) ALDH1A1CA2TSHRTDP1MAPK1
SCHEMBL2497842 0.72 ALDH1A1 (0.43) ALDH1A1CA2ALOX15ALOX12CA1
SCHEMBL14131096 0.72 KMT2A (0.33) ALDH1A1CA2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4622380-A Alkylidene bromo-substituted arylene acetal and/or ketal polymers PPG INDUSTRIES, INC. (US) 1986-11-11 — — US claimed
US-4489189-A FROM TETRABROMOBISPHENOL A AND ETHYLENE GLYCOL PPG INDUSTRIES, INC. (US) 1984-12-18 — — US claimed
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-4622380-A Alkylidene bromo-substituted arylene acetal and/or ketal polymers PPG INDUSTRIES, INC. (US) 1986-11-11 — — US disclosed
US-4489189-A FROM TETRABROMOBISPHENOL A AND ETHYLENE GLYCOL PPG INDUSTRIES, INC. (US) 1984-12-18 — — US disclosed
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