SCHEMBL9836015

SCHEMBL9836015

[CH]=CCCCCCCCC(=O)N(CCc1ccccc1)OC

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.45
KDM4A O75164 2/20 0.44
KDM4C Q9H3R0 2/20 0.44
KDM5A P29375 1/20 0.44
PHF8 Q9UPP1 1/20 0.44
KDM2A Q9Y2K7 1/20 0.44
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HDAC1 Q13547 1/20 0.39
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
EPHX2 P34913 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CES1 P23141 1/20 0.37

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
SCHEMBL9835526 0.79 BCHE (0.44) ALOX5KDM4AKDM4CHDAC1BCHE
SCHEMBL9836621 0.75 LMNA (0.35) MAPTEPHX2MEN1KMT2ATDP1
SCHEMBL5544624 0.73 TAAR1 (0.48) ALOX5MEN1NPC1RAB9AKMT2A
SCHEMBL9836351 0.72 THRA (0.48) ALOX5KDM4AKDM4CKDM5APHF8
SCHEMBL8735183 0.69 SIGMAR1 (0.52) MAPTRXFP1
SCHEMBL542369 0.69 SIGMAR1 (0.52) MAPTRXFP1
SCHEMBL17558060 0.69 SIGMAR1 (0.52) MAPTRXFP1
SCHEMBL1144005 0.69 SIGMAR1 (0.52) MAPTRXFP1
SCHEMBL3939372 0.69 SIGMAR1 (0.52) MAPTRXFP1
SCHEMBL11128969 0.69 SIGMAR1 (0.52) MAPTRXFP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0200377-B1 HYDROXAMATES SQUIBB & SONS INC (US) 1991-10-09 EP disclosed
EP-0200377-A2 Hydroxamates E.R. Squibb & Sons, Inc. (US) 1986-11-05 EP disclosed
US-4604407-A Hydroxamates E. R. SQUIBB & SONS, INC. (US) 1986-08-05 US disclosed