SCHEMBL7066085

SCHEMBL7066085

COCC(Br)(COC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.42
KCNN4 O15554 5/20 0.40
ALOX15 P16050 2/20 0.40
ALDH1A1 P00352 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
CES1 P23141 1/20 0.36
TSHR P16473 2/20 0.36
CA4 P22748 1/20 0.36
KIF11 P52732 1/20 0.35

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
SCHEMBL235054 0.80 MAPK1 (0.42) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL5972484 0.80 KIF11 (0.43) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL6494684 0.79 KCNN4 (0.41) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL8278933 0.78 TAAR1 (0.54) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL812875 0.78 CYP2C19 (0.48) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL28224667 0.78 MAPK1 (0.46) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL2128913 0.78 MAPK1 (0.37) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL7066960 0.76 TSHR (0.44) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL14359797 0.76 ALDH1A1 (0.44) MAPK1KCNN4ALOX15ALDH1A1TAAR1
SCHEMBL6293779 0.76 KCNN4 (0.42) MAPK1KCNN4ALOX15ALDH1A1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891988-B1 Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE SPA (IT) 2003-06-04 EP disclosed
EP-0451645-B1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC (US) 1999-05-12 EP disclosed
EP-0891988-A2 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1999-01-20 EP disclosed
US-5068213-A COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS HINMONT INCORPORATED (US) 1991-11-26 US disclosed
EP-0451645-A2 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1991-10-16 EP disclosed