SCHEMBL9819347

SCHEMBL9819347

CNC(=O)N(CCC(=O)O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 6/20 0.44
FFAR1 O14842 1/20 0.42
ROCK2 O75116 3/20 0.40
MTOR P42345 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
F2 P00734 1/20 0.39
PTPN1 P18031 1/20 0.39
EPHX2 P34913 1/20 0.39
SERPINE1 P05121 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL9819254 0.83 RXRA (0.44) FFAR1HDAC6F2
SCHEMBL11876392 0.81 HDAC6 (0.38) MLYCDROCK2MTORHDAC6PTPN1
SCHEMBL9819339 0.80 ROCK2 (0.43) FFAR1ROCK2
SCHEMBL23804581 0.74 MLYCD (0.49) MLYCDROCK2MTOREPHX2
SCHEMBL11821275 0.74 EPHX2 (0.43) MTORHDAC6EPHX2
SCHEMBL20472411 0.73 ROCK2 (0.46) MLYCDROCK2
SCHEMBL7837974 0.72 MLYCD (0.50) MLYCDPTPN1
SCHEMBL20472413 0.71 MLYCD (0.43) MLYCDROCK2
SCHEMBL6229257 0.71 MLYCD (0.54) MLYCDMTORSERPINE1
SCHEMBL27949212 0.71 FFAR1 (0.42) MLYCDFFAR1MTORPTPN1EPHX2

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
EP-0162669-B1 ANTICONVULSIVE COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-12-11 EP disclosed
US-4588729-A Treating convulsions with dihydrouracil derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1986-05-13 US disclosed