SCHEMBL8225469

SCHEMBL8225469

COC1CN[C@@H](C(=O)NC2=CC3=C(CC2)CN(C)CC3)C1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTSC P53634 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
SCHEMBL12101328 0.76 ROCK2 (0.41) CTSC
SCHEMBL2278960 0.75 NPC1 (0.41) CTSC
SCHEMBL3440741 0.75 CLK2 (0.43) CTSC
SCHEMBL3856350 0.66 ALDH1A1 (0.51) CTSC
SCHEMBL3856353 0.66 ALDH1A1 (0.51) CTSC
SCHEMBL12101309 0.64 CTSC (0.38) CTSC
SCHEMBL6938708 0.64 CTSC (0.46) CTSC
SCHEMBL6944352 0.64 CTSC (0.46) CTSC
SCHEMBL6938705 0.64 CTSC (0.46) CTSC
SCHEMBL14320133 0.62 CTSC (0.42) CTSC

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-2007131982-A2 SUBSTITUTED PROLINAMIDES, PRODUCTION THEREOF AND THEIR USE AS DRUGS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-11-22 WO disclosed