SCHEMBL11070495

SCHEMBL11070495

CCCCCCCCC=CCCCCCCCCNc1cccc(C(=O)NC(=O)c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC11 Q96DB2 1/20 0.56
HDAC8 Q9BY41 1/20 0.56
NAAA Q02083 1/20 0.51
SOAT2 O75908 1/20 0.51
SOAT1 P35610 1/20 0.51
EPHX2 P34913 3/20 0.45
F2R P25116 2/20 0.44
FAAH O00519 2/20 0.44
EPHX1 P07099 3/20 0.43
ALDH1A1 P00352 3/20 0.43
NR1H4 Q96RI1 2/20 0.43
HTT P42858 1/20 0.43
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
PLK1 P53350 2/20 0.43

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
SCHEMBL11070493 1.00 HDAC11 (0.56) HDAC11HDAC8NAAASOAT2SOAT1
SCHEMBL11486775 0.89 NAAA (0.55) NAAASOAT2SOAT1EPHX2FAAH
SCHEMBL11486773 0.89 NAAA (0.55) NAAASOAT2SOAT1EPHX2FAAH
SCHEMBL11070282 0.88 SOAT2 (0.52) HDAC11HDAC8NAAASOAT2SOAT1
SCHEMBL11070287 0.88 SOAT2 (0.52) HDAC11HDAC8NAAASOAT2SOAT1
SCHEMBL11065027 0.85 SOAT2 (0.52) HDAC11HDAC8SOAT2SOAT1EPHX2
SCHEMBL11065030 0.85 SOAT2 (0.52) HDAC11HDAC8SOAT2SOAT1EPHX2
SCHEMBL11076560 0.82 SOAT2 (0.49) HDAC11HDAC8SOAT2SOAT1EPHX2
SCHEMBL11076556 0.82 SOAT2 (0.49) HDAC11HDAC8SOAT2SOAT1EPHX2
SCHEMBL11063612 0.82 SOAT2 (0.48) HDAC11HDAC8SOAT2SOAT1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4440940-A HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-04-03 US disclosed