SCHEMBL7538172

SCHEMBL7538172

CCCCCN(CC)CCCCC/C=C\CCCCCCCCNC(=O)C(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.63
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
EPHX2 P34913 11/20 0.49
FAAH O00519 3/20 0.48
CES1 P23141 2/20 0.48
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLC6A5 Q9Y345 1/20 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
SCHEMBL7543543 1.00 EPHX1 (0.63) EPHX1MEN1KMT2AEPHX2FAAH
SCHEMBL7538176 0.95 EPHX1 (0.55) EPHX1MEN1KMT2AEPHX2FAAH
SCHEMBL7535887 0.92 EPHX1 (0.63) EPHX1MEN1KMT2AEPHX2FAAH
SCHEMBL7542534 0.92 EPHX1 (0.63) EPHX1MEN1KMT2AEPHX2FAAH
SCHEMBL7539126 0.92 EPHX1 (0.75) EPHX1MEN1KMT2AALDH1A1POLB
SCHEMBL7535768 0.92 EPHX1 (0.75) EPHX1MEN1KMT2AALDH1A1POLB
SCHEMBL7542355 0.92 EPHX1 (0.75) EPHX1MEN1KMT2AALDH1A1POLB
SCHEMBL7536111 0.92 EPHX1 (0.75) EPHX1MEN1KMT2AALDH1A1POLB
SCHEMBL7535792 0.91 EPHX1 (0.61) EPHX1MEN1KMT2AEPHX2FAAH
SCHEMBL7542360 0.86 EPHX1 (0.65) EPHX1MEN1KMT2AFAAHCES1

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-1200454-A1 BISPLATINUM COMPLEXES ACTIVE THROUGH THE ORAL ROUTE Novuspharma S.p.A. (IT) 2002-05-02 EP disclosed
WO-2001009149-A1 BISPLATINUM COMPLEXES ACTIVE THROUGH THE ORAL ROUTE NOVUSPHARMA S.P.A. (IT) 2001-02-08 WO disclosed