SCHEMBL11237441

SCHEMBL11237441

CCCCCCCCCCCCCCCNc1ccc(CCC(=O)OCC(O)CO)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.56
DUSP3 P51452 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
LMNA P02545 1/20 0.56
DGKA P23743 1/20 0.50
CNR2 P34972 3/20 0.48
FAAH O00519 2/20 0.48
P2RY10 O00398 3/20 0.46
GPR174 Q9BXC1 3/20 0.46
SPHK1 Q9NYA1 4/20 0.44
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42

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
SCHEMBL11237134 1.00 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11238302 1.00 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11225752 0.94 KDM4E (0.59) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11241552 0.94 KDM4E (0.59) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11243750 0.94 KDM4E (0.59) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11304340 0.92 DGKA (0.61) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11229504 0.88 MAPT (0.55) P2RY10GPR174SPHK1CYP4F2CYP4A11
SCHEMBL11238716 0.88 MAPT (0.55) P2RY10GPR174SPHK1CYP4F2CYP4A11
SCHEMBL11244214 0.88 MAPT (0.55) P2RY10GPR174SPHK1CYP4F2CYP4A11
SCHEMBL11303411 0.87 DGKA (0.64) KDM4EDUSP3MEN1KMT2ALMNA

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-4348399-A Antiatherosclerotic and hypolipidemic 4-(monoalkylamino)phenyl alkane, alkene and alkyne carbinols, aldehydes, carboxylic acids and derivatives AMERICAN CYANAMID COMPANY (US) 1982-09-07 US disclosed