SCHEMBL7735332

SCHEMBL7735332

COc1ccc(-c2cc(CCC(=O)O)ccc2OCC2CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.51
FFAR4 Q5NUL3 3/20 0.51
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
ELANE P08246 1/20 0.47
S1PR1 P21453 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
PARP15 Q460N3 1/20 0.45
PARP10 Q53GL7 1/20 0.45
PTGDR2 Q9Y5Y4 2/20 0.44
C5AR1 P21730 1/20 0.44

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
SCHEMBL3884521 0.92 THRA (0.48) FFAR1FFAR4THRATHRBELANE
SCHEMBL7735792 0.91 MEN1 (0.47) ELANEMEN1KMT2APDE4APDE4B
SCHEMBL7735134 0.88 THRA (0.52) FFAR1FFAR4THRATHRBS1PR1
SCHEMBL1013811 0.88 THRA (0.54) FFAR1FFAR4THRATHRBS1PR1
SCHEMBL7725119 0.87 THRA (0.52) FFAR1FFAR4THRATHRBS1PR1
SCHEMBL8984902 0.87 THRA (0.60) FFAR1FFAR4THRATHRBS1PR1
SCHEMBL3881805 0.85 THRA (0.47) FFAR1FFAR4THRATHRBS1PR1
SCHEMBL3888439 0.84 FFAR4 (0.54) FFAR1FFAR4THRATHRBS1PR1
SCHEMBL3890186 0.84 PPARD (0.49) FFAR1FFAR4THRATHRBELANE
SCHEMBL3885965 0.84 THRA (0.50) FFAR1FFAR4THRATHRBS1PR1

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-6376546-B1 ANTIALLERGENS ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-04-23 US claimed
EP-1024130-A1 BIPHENYL-5-ALKANOIC ACID DERIVATIVES AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-08-02 EP claimed
US-6376546-B1 ANTIALLERGENS ASAHI KASEI KABUSHIKI KAISHA (JP) 2002-04-23 US disclosed
EP-1024130-A1 BIPHENYL-5-ALKANOIC ACID DERIVATIVES AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-08-02 EP disclosed