SCHEMBL14463255

SCHEMBL14463255

CCCc1cccc(OC(CC)CC)c1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.45
▸ PPARG P37231 3/20 0.43
▸ PPARA Q07869 3/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ CHRM2 P08172 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 1/20 0.41
▸ ACHE P22303 1/20 0.40
▸ ACACB O00763 1/20 0.40

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
SCHEMBL12881236 0.84 ALOX5 (0.49) ALOX5PPARGPPARATAAR1CHRM2
SCHEMBL13802842 0.82 TSHR (0.45) TAAR1ACACB
SCHEMBL1696256 0.82 DAO (0.54) ALOX5PPARGPPARATAAR1CHRM2
SCHEMBL5245979 0.81 ALOX5 (0.47) ALOX5PPARGPPARATAAR1ACHE
SCHEMBL22047298 0.79 TAAR1 (0.49) ALOX5PPARGPPARATAAR1ACHE
SCHEMBL13759569 0.79 ALOX5 (0.43) ALOX5PPARGPPARATAAR1ACHE
SCHEMBL26218121 0.79 TAAR1 (0.50) ALOX5PPARGPPARATAAR1CHRM2
SCHEMBL156300 0.77 TAAR1 (0.69) TAAR1CHRM2CHRM1CHRM3
SCHEMBL28593565 0.77 PTGDR2 (0.52) ALOX5PPARGPPARA
SCHEMBL30230412 0.77 CHRM2 (0.51) ALOX5CHRM2CHRM1CHRM3ACHE

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-1409577-B1 FLAME RESISTANT THERMOPLASTIC MOULDING MATERIALS BASF AG (DE) 2007-07-25 — — EP disclosed
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