SCHEMBL9754660

SCHEMBL9754660

CCCCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CC

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 1/20 0.36
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
HRH3 Q9Y5N1 6/20 0.35
HDAC6 Q9UBN7 4/20 0.35
HRH4 Q9H3N8 4/20 0.35
HDAC1 Q13547 2/20 0.35
XDH P47989 1/20 0.34
RNASEL Q05823 1/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 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
SCHEMBL9754686 0.92 ITGB3 (0.40) LMNAL3MBTL1SMN1; SMN2MAPK1ITGB3
SCHEMBL6130186 0.89 ITGB3 (0.41) LMNAITGB3ITGA2BHRH3HDAC6
SCHEMBL3337469 0.86 LMNA (0.39) LMNAL3MBTL1SMN1; SMN2MAPK1HRH3
SCHEMBL17633568 0.85 LMNA (0.39) LMNAL3MBTL1SMN1; SMN2MAPK1HRH3
Hydrochloric Acid SCHEMBL3337935 0.85 LMNA (0.39) LMNAL3MBTL1SMN1; SMN2MAPK1HRH3
SCHEMBL6130195 0.85 ITGB3 (0.45) SMN1; SMN2ITGB3ITGA2BHDAC6HDAC1
SCHEMBL3916325 0.85 ITGB3 (0.45) SMN1; SMN2ITGB3ITGA2BHDAC6HDAC1
SCHEMBL8678436 0.85 ITGB3 (0.45) SMN1; SMN2ITGB3ITGA2BHDAC6HDAC1
SCHEMBL8678394 0.85 ITGB3 (0.45) SMN1; SMN2ITGB3ITGA2BHDAC6HDAC1
SCHEMBL3334899 0.82 EPHX1 (0.42) LMNASMN1; SMN2HRH3XDHNPC1

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-1992000068-A1 SUBSTITUTED HISTIDINES SMITHKLINE BEECHAM CORPORATION (US) 1992-01-09 WO disclosed