SCHEMBL23710202

SCHEMBL23710202

CNNCCCC1CCN(C(=O)C(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.47
EPHX2 P34913 4/20 0.37
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ITGB3 P05106 4/20 0.35
ITGA2B P08514 4/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
GPR119 Q8TDV5 2/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
XBP1 P17861 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL23710176 0.88 FAAH (0.49) FAAHEPHX2L3MBTL1ITGB3ITGA2B
SCHEMBL23710138 0.82 FAAH (0.47) FAAHEPHX2L3MBTL1ITGB3ITGA2B
SCHEMBL27270190 0.81 FAAH (0.45) FAAHEPHX2L3MBTL1MEN1ALDH1A1
SCHEMBL26224205 0.80 FAAH (0.52) FAAHITGB3ITGA2BMEN1ALDH1A1
SCHEMBL19049366 0.79 FAAH (0.49) FAAHEPHX2RAB9AL3MBTL1ALDH1A1
SCHEMBL23560471 0.78 FAAH (0.51) FAAHITGB3ITGA2BMEN1ALDH1A1
SCHEMBL25915855 0.77 GNAI3 (0.51) FAAHITGB3ITGA2BMEN1KMT2A
SCHEMBL23695831 0.77 FAAH (0.50) FAAHEPHX2L3MBTL1ITGB3ITGA2B
SCHEMBL25075013 0.77 FAAH (0.50) FAAHEPHX2L3MBTL1ITGB3ITGA2B
SCHEMBL18513691 0.76 FAAH (0.48) FAAHEPHX2L3MBTL1MEN1ALDH1A1

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-3858832-A1 TRIFLUOROMETHYL-SUBSTITUTED SULFONAMIDE AS BCL-2-SELECTIVE INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-08-04 EP disclosed