SCHEMBL9147238

SCHEMBL9147238

CCCCCCC(=O)Oc1ccc(-c2ccc(OCCC[C@@H](C)CC)c(F)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.45
PPARA Q07869 2/20 0.45
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
RARA P10276 1/20 0.41
RARB P10826 1/20 0.41
PTPN11 Q06124 2/20 0.40
KMT2A Q03164 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
S1PR1 P21453 1/20 0.39
FAAH O00519 1/20 0.39
TOP2A P11388 2/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
MGLL Q99685 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ESR1 P03372 1/20 0.38

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
SCHEMBL9145326 1.00 PPARG (0.45) PPARGPPARATHRATHRBALOX15
SCHEMBL9518615 1.00 PPARG (0.45) PPARGPPARATHRATHRBALOX15
SCHEMBL9149139 0.91 ALOX15 (0.44) PPARGPPARATHRATHRBALOX15
SCHEMBL9145910 0.91 ALOX15 (0.44) PPARGPPARATHRATHRBALOX15
SCHEMBL9479205 0.90 THRA (0.51) PPARGPPARATHRATHRBRARA
SCHEMBL9476333 0.90 THRA (0.51) PPARGPPARATHRATHRBRARA
SCHEMBL9475902 0.90 THRA (0.51) PPARGPPARATHRATHRBRARA
SCHEMBL9477118 0.90 THRA (0.51) PPARGPPARATHRATHRBRARA
SCHEMBL9479168 0.90 THRA (0.51) PPARGPPARATHRATHRBRARA
SCHEMBL9652131 0.90 THRA (0.51) PPARGPPARATHRATHRBRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5397504-A Liquid crystal KANTO KAGAKU KABUSHIKI KAISHA (JP) 1995-03-14 US claimed
US-5397504-A Liquid crystal KANTO KAGAKU KABUSHIKI KAISHA (JP) 1995-03-14 US disclosed
EP-0315701-B1 BIPHENYL COMPOUND KANTO KAGAKU (JP) 1993-12-29 EP disclosed
EP-0315701-A1 BIPHENYL COMPOUND KANTO KAGAKU KABUSHIKI KAISHA (JP) 1989-05-17 EP disclosed