SCHEMBL6964948

SCHEMBL6964948

[O]C(=O)CCc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.54
CASP3 P42574 1/20 0.48
CASP7 P55210 1/20 0.48
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
AOC3 Q16853 1/20 0.44
MAOB P27338 3/20 0.44
MAPK1 P28482 1/20 0.44
PARP15 Q460N3 1/20 0.44
PARP14 Q460N5 1/20 0.44
PARP10 Q53GL7 1/20 0.44
MPO P05164 1/20 0.43
CNR1 P21554 1/20 0.43
ADORA2B P29275 1/20 0.43
ACKR3 P25106 1/20 0.43
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
PPIA P62937 1/20 0.42

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
SCHEMBL7331602 0.85 TAAR1 (0.56) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL6969660 0.85 ALDH1A1 (0.51) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL246473 0.83 MEN1 (0.59) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL29444401 0.83 MEN1 (0.59) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL2859015 0.82 TAAR1 (0.57) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL2527059 0.82 TAAR1 (0.52) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL27383065 0.82 TAAR1 (0.52) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL11549937 0.82 TAAR1 (0.52) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL9220937 0.82 IAPP (0.55) TAAR1CASP3CASP7ALDH1A1MEN1
SCHEMBL30799043 0.82 TAAR1 (0.52) TAAR1CASP3CASP7ALDH1A1MEN1

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed