SCHEMBL14448387

SCHEMBL14448387

CC(=N)N1CCC(C(=O)ONN)CC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 2/20 0.40
POLB P06746 1/20 0.40
CPN1 P15169 1/20 0.40
CPB2 Q96IY4 1/20 0.40
MAPT P10636 2/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 5/20 0.37
F10 P00742 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL10178373 0.84 SMN1; SMN2 (0.59) SMN1; SMN2GAAPOLBCPN1CPB2
SCHEMBL14344751 0.82 CPN1 (0.41) SMN1; SMN2GAAPOLBCPN1CPB2
SCHEMBL12132347 0.76 MAPT (0.66) SMN1; SMN2GAAPOLBMAPTTSHR
SCHEMBL14344917 0.76 MAPT (0.44) SMN1; SMN2GAAPOLBCPN1CPB2
SCHEMBL8277480 0.76 GAA (0.55) SMN1; SMN2GAAPOLBCPN1CPB2
SCHEMBL14621736 0.75 CPN1 (0.47) SMN1; SMN2GAACPN1CPB2MAPT
SCHEMBL8279747 0.74 LMNA (0.52) SMN1; SMN2GAAPOLBCPN1CPB2
SCHEMBL27416738 0.71 SMN1; SMN2 (0.45) SMN1; SMN2GAAPOLBMAPTTSHR
SCHEMBL10143821 0.69 CPN1 (0.46) SMN1; SMN2GAACPN1CPB2MAPT
SCHEMBL14366136 0.69 CPN1 (0.42) SMN1; SMN2GAACPN1CPB2MAPT

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-1373194-B1 BENZAMIDE INHIBITORS OF FACTOR Xa MILLENNIUM PHARM INC (US) 2007-08-01 EP disclosed