SCHEMBL9833716

SCHEMBL9833716

CCCCCCN(O)C(=O)CCCc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.72
KDM4C Q9H3R0 5/20 0.65
KDM5A P29375 4/20 0.65
PHF8 Q9UPP1 4/20 0.65
KDM4A O75164 3/20 0.65
KDM2A Q9Y2K7 1/20 0.65
KCNH2 Q12809 1/20 0.55
THRA P10827 1/20 0.52
THRB P10828 1/20 0.52
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49

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
SCHEMBL9836494 1.00 ALOX5 (0.72) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL9836200 0.98 ALOX5 (0.74) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL28147120 0.94 ALOX5 (0.72) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL9834381 0.94 ALOX5 (0.77) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL14553382 0.86 ALOX5 (0.79) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL9833833 0.84 ALOX5 (1.00) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL11135720 0.84 KCNH2 (0.60) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL10692283 0.83 ALOX5 (0.79) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL10695268 0.81 ALOX5 (1.00) ALOX5KDM4CKDM5APHF8KDM4A
SCHEMBL9546190 0.80 ALOX5 (0.49) ALOX5KDM4CKDM5APHF8KDM4A

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