SCHEMBL19622397

SCHEMBL19622397

CCCCCCCCCCCCCCC(O)[C@H](O)C(CO)NC(=O)c1ccccc1C

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ASAH1 Q13510 1/20 0.45
THRB P10828 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SPHK2 Q9NRA0 1/20 0.39
SPHK1 Q9NYA1 1/20 0.39
UTS2R Q9UKP6 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
NAAA Q02083 1/20 0.38
CSNK1E P49674 1/20 0.38
CNR2 P34972 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CERT1 Q9Y5P4 2/20 0.37
CCR1 P32246 1/20 0.37

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
SCHEMBL12207249 1.00 KMT2A (0.46) KMT2AMEN1ASAH1THRBL3MBTL1
SCHEMBL29388707 0.88 NAAA (0.52) KMT2AMEN1ASAH1SPHK2SPHK1
SCHEMBL8405511 0.88 NAAA (0.52) KMT2AMEN1ASAH1SPHK2SPHK1
SCHEMBL19622263 0.86 KMT2A (0.45) KMT2AMEN1ASAH1THRBL3MBTL1
SCHEMBL1854511 0.84 PRSS1 (0.52) KMT2AMEN1ASAH1PRSS1NAAA
SCHEMBL12206883 0.82 CETP (0.46) KMT2AMEN1ASAH1THRBL3MBTL1
SCHEMBL13215712 0.76 HPGD (0.46) KMT2AMEN1ASAH1SPHK2SPHK1
SCHEMBL24336178 0.75 MEN1 (0.56) KMT2AMEN1ASAH1SPHK1
SCHEMBL21594653 0.75 MEN1 (0.56) KMT2AMEN1ASAH1SPHK1
SCHEMBL21594651 0.75 MEN1 (0.56) KMT2AMEN1ASAH1SPHK1

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
EP-2328546-B1 AQUEOUS COSMETIC PREPARATION AND METHOD FOR PRODUCING THE SAME FUJIFILM CORP (JP) 2017-11-22 EP disclosed