SCHEMBL7367036

SCHEMBL7367036

N#Cc1ccccc1CCCCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.55
MAPT P10636 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
F13A1 P00488 3/20 0.47
HDAC3 O15379 2/20 0.46
HDAC4 P56524 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC7 Q8WUI4 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC10 Q969S8 2/20 0.46
HDAC11 Q96DB2 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
HDAC9 Q9UKV0 2/20 0.46
HDAC5 Q9UQL6 2/20 0.46
MAPK1 P28482 1/20 0.46
ADRA1A P35348 1/20 0.46
SLC6A3 Q01959 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
FFAR4 Q5NUL3 2/20 0.45

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
SCHEMBL7906876 0.95 FFAR1 (0.56) FFAR1MAPTRXFP1HDAC3HDAC4
SCHEMBL30740885 0.88 FFAR1 (0.62) FFAR1FFAR4
SCHEMBL447652 0.88 FFAR1 (0.62) FFAR1FFAR4
SCHEMBL28248440 0.84 CYP19A1 (0.46) FFAR1MAPTSMN1; SMN2
Phenyl Propionic Acid SCHEMBL5407020 0.82 FFAR1 (0.68) FFAR1HDAC3HDAC4HDAC1HDAC7
SCHEMBL22826566 0.82 MAPT (0.67) MAPTRXFP1F13A1HDAC3HDAC4
SCHEMBL7094632 0.81 TSHR (0.52) FFAR1
SCHEMBL29045424 0.81 FFAR1 (0.46) FFAR1MAPTSMN1; SMN2FFAR4
SCHEMBL28248935 0.80 CYP19A1 (0.46) FFAR1MAPTSMN1; SMN2
SCHEMBL6952816 0.79 FFAR1 (0.46) FFAR1SMN1; SMN2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5441974-A Phenyl amidines lactones useful as platelet aggregation inhibitors G. D. SEARLE & CO. (US) 1995-08-15 US disclosed
WO-1993012103-A1 PHENYL AMIDINES LACTONES USEFUL AS PLATELET AGGREGATION INHIBITORS G.D. SEARLE & CO. (US) 1993-06-24 WO disclosed