SCHEMBL2491902

SCHEMBL2491902

[CH]=Cc1ccc(C(C)CCl)cc1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.34
GRIA4 P48058 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
TAAR1 Q96RJ0 2/20 0.30

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
SCHEMBL536253 0.82 ESR1 (0.41) ESR1ESR2TAAR1
SCHEMBL2490657 0.79 ABCB11 (0.41) TYRGRIA4ESR1ESR2TAAR1
SCHEMBL2467595 0.79 ALDH1A1 (0.46) TYRGRIA4ESR1ESR2TAAR1
SCHEMBL2494634 0.76 TYR (0.32) TYRGRIA4
SCHEMBL694439 0.75 TYR (0.58) TYR
SCHEMBL18045114 0.73 ACHE (0.48) GRIA4ESR1ESR2TAAR1
SCHEMBL11239990 0.71 ESR1 (0.59) ESR1ESR2TAAR1
SCHEMBL10281071 0.71 AOC3 (0.38)
SCHEMBL10857961 0.71 GRIA4 (0.43) GRIA4ESR1ESR2TAAR1
SCHEMBL1304417 0.71 ESR1 (0.43) ESR1ESR2TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395622-B1 ARBORESCENT THERMOPLASTIC ELASTOMERS AND PRODUCTS THEREFROM AUSTIN VENTURE PARTNERS LLC (US) 2011-10-05 EP claimed