SCHEMBL9835338

SCHEMBL9835338

CCCCCCCCCCC(CCCCCC)CCC(=O)N(O)CCCC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 10/20 0.42
KDM5A P29375 8/20 0.42
PHF8 Q9UPP1 5/20 0.42
KDM4A O75164 3/20 0.41
KDM2A Q9Y2K7 1/20 0.41
MEN1 O00255 1/20 0.40
FAAH O00519 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
SOAT1 P35610 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM5C P41229 1/20 0.40
KDM5B Q9UGL1 1/20 0.40

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
SCHEMBL9837192 0.84 KDM5A (0.57) KDM4CKDM5APHF8KDM4AMEN1
SCHEMBL5571197 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL12048764 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL28156538 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL18978503 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL25491675 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL28156546 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL21207379 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL22803309 0.82 SOAT1 (0.52) MEN1FAAHTP53CYP1A2CYP3A4
SCHEMBL21207649 0.80 SOAT1 (0.53) MEN1FAAHTP53CYP1A2CYP3A4

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