SCHEMBL11244569

SCHEMBL11244569

COC(=O)CCc1ccc(NCc2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.76
FFAR4 Q5NUL3 6/20 0.76
TDP1 Q9NUW8 2/20 0.50
GNA15 P30679 1/20 0.50
PTGER3 P43115 1/20 0.50
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
THRB P10828 1/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL11249779 0.90 FFAR1 (0.71) FFAR1FFAR4TDP1GNA15PTGER3
SCHEMBL11242235 0.88 FFAR1 (0.80) FFAR1FFAR4TDP1GNA15PTGER3
SCHEMBL11233308 0.88 FFAR1 (0.65) FFAR1FFAR4TDP1KDM4EMEN1
SCHEMBL13840567 0.87 FFAR1 (0.59) FFAR1FFAR4TDP1GNA15PTGER3
SCHEMBL30645136 0.86 FFAR4 (0.54) FFAR1FFAR4TDP1KDM4EMEN1
SCHEMBL365306 0.86 FFAR4 (0.54) FFAR1FFAR4TDP1KDM4EMEN1
SCHEMBL11244562 0.81 RXFP1 (0.54) FFAR1FFAR4TDP1KDM4EMEN1
SCHEMBL12059419 0.81 MAPT (0.61) MEN1KMT2A
SCHEMBL12646504 0.80 MAOB (0.57) FFAR1FFAR4
SCHEMBL11240957 0.80 FFAR1 (0.67) FFAR1FFAR4TDP1MEN1KMT2A

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-4362892-A ARALKYLANILINES, ANTICHOLESTEROL AGENTS BEECHAM GROUP LIMITED (GB) 1982-12-07 US disclosed
US-4206145-A ALKANOYL-SUBSTITUTED ARALKYLAMINES BEECHAM GROUP LIMITED (GB) 1980-06-03 US disclosed