SCHEMBL15740339

SCHEMBL15740339

CCCCNC[C@H]1CCCO1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
ALOX12 P18054 1/20 0.44
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
ANPEP P15144 1/20 0.43
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL12846940 1.00 USP2 (0.45) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL14196079 1.00 USP2 (0.45) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL11061885 0.95 KDM4E (0.41) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL13102163 0.89 KMT2A (0.45) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL2239461 0.89 KMT2A (0.45) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL15671149 0.88 USP2 (0.50) USP2SMN1; SMN2TP53HPGDALOX12
Bromide SCHEMBL15671179 0.86 KMT2A (0.50) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL11061356 0.83 KDM4E (0.43) USP2SMN1; SMN2HPGDKDM4EPKM
SCHEMBL10151332 0.81 ANPEP (0.46) USP2SMN1; SMN2TP53HPGDALOX12
SCHEMBL11413505 0.81 KMT2A (0.46) USP2SMN1; SMN2TP53HPGDALOX12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150328329-A1 LIGANDS THAT TARGET HCV-E2 BINDING SITES ON CD81 AND THERAPEUTIC METHODS USING THEM American University of Cairo (EG) 2015-11-19 US disclosed
WO-2014081856-A2 LIGANDS THAT TARGET HCV-E2 BINDING SITES ON CD81 AND THERAPEUTIC METHODS USING THEM AZZAZY HASSAN (EG) 2014-05-30 WO disclosed