SCHEMBL11235397

SCHEMBL11235397

O=C(O)c1ccc(NCc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.70
FFAR4 Q5NUL3 1/20 0.70
NR4A2 P43354 2/20 0.60
MLYCD O95822 1/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
SERPINE1 P05121 2/20 0.56
HDAC3 O15379 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
SRD5A2 P31213 1/20 0.55
HIF1A Q16665 1/20 0.54
MAPK14 Q16539 1/20 0.54
POLB P06746 1/20 0.53
CRHBP P24387 1/20 0.53
HTT P42858 1/20 0.53
CRHR2 Q13324 1/20 0.53

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
SCHEMBL14044105 0.89 MAPK14 (0.58) FFAR1FFAR4NR4A2MAPK14TDP1
SCHEMBL14043912 0.89 NR4A2 (0.71) FFAR1FFAR4NR4A2MEN1KMT2A
SCHEMBL28585261 0.87 RXRA (0.55) FFAR1FFAR4NR4A2MLYCDSERPINE1
SCHEMBL20236127 0.86 PPARA (0.62) FFAR1FFAR4NR4A2MEN1KMT2A
SCHEMBL4242744 0.84 FFAR1 (0.66) FFAR1FFAR4MEN1KMT2AHDAC3
SCHEMBL11246781 0.83 FFAR1 (0.60) FFAR1FFAR4MLYCDMEN1KMT2A
SCHEMBL20236549 0.82 FFAR1 (0.69) FFAR1FFAR4SERPINE1HDAC3HDAC1
SCHEMBL2195496 0.81 FFAR1 (0.68) FFAR1NR4A2MEN1KMT2ANPC1
SCHEMBL11240957 0.81 FFAR1 (0.67) FFAR1FFAR4MLYCDMEN1KMT2A
SCHEMBL11397600 0.81 P4HTM (0.61) FFAR1FFAR4MEN1KMT2AHDAC3

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
US-4362892-A ARALKYLANILINES, ANTICHOLESTEROL AGENTS BEECHAM GROUP LIMITED (GB) 1982-12-07 US disclosed