SCHEMBL13755916

SCHEMBL13755916

CCCCCCCCCCCCC(C)NC(=O)CCN(C)CCCNC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ PLA2G10 O15496 2/20 0.41
▸ DNM1 Q05193 2/20 0.40
▸ S1PR2 O95136 1/20 0.40
▸ S1PR1 P21453 1/20 0.40
▸ S1PR3 Q99500 1/20 0.40
▸ S1PR5 Q9H228 1/20 0.40
▸ PLA2G2C Q5R387 1/20 0.39
▸ KDM5A P29375 3/20 0.38
▸ KDM4C Q9H3R0 2/20 0.38
▸ PHF8 Q9UPP1 1/20 0.38
▸ NOD1 Q9Y239 1/20 0.36
▸ KDM5C P41229 1/20 0.36
▸ KDM5B Q9UGL1 1/20 0.36
▸ EPHX1 P07099 1/20 0.36
▸ KCNK3 O14649 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL13755986 0.93 FAAH (0.43) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL10820690 0.93 FAAH (0.43) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL10820654 0.89 FAAH (0.49) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756015 0.88 FAAH (0.41) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756161 0.88 FAAH (0.41) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756039 0.88 FAAH (0.41) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756162 0.88 FAAH (0.43) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756142 0.88 FAAH (0.43) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756037 0.85 SLC6A5 (0.43) FAAHMEN1KMT2AMAPK1PLA2G10
SCHEMBL13756144 0.84 FAAH (0.42) FAAHMEN1KMT2AMAPK1PLA2G10

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
WO-2009097332-A2 THERAPEUTIC COMPOSITIONS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2009-08-06 — — WO disclosed
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