SCHEMBL11241552

SCHEMBL11241552

CCCCCCCCNc1ccc(CCCC(=O)OCC(O)CO)cc1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.59
DUSP3 P51452 1/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
LMNA P02545 1/20 0.59
CNR2 P34972 4/20 0.53
DGKA P23743 1/20 0.52
FAAH O00519 3/20 0.50
ADRB2 P07550 1/20 0.49
ADRB1 P08588 1/20 0.49
ADRB3 P13945 1/20 0.49
SPHK1 Q9NYA1 7/20 0.46
SPHK2 Q9NRA0 1/20 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
SCHEMBL11225752 1.00 KDM4E (0.59) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11243750 1.00 KDM4E (0.59) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11238302 0.94 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11237441 0.94 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11237134 0.94 KDM4E (0.56) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11303411 0.92 DGKA (0.64) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11239282 0.89 MAPT (0.57) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11304340 0.86 DGKA (0.61) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL11240378 0.85 CYP4Z1 (0.52) FAAHSPHK1
SCHEMBL11229504 0.83 MAPT (0.55) SPHK1

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