SCHEMBL11245485

SCHEMBL11245485

COC1CN(C)CCC1Oc1cccc(C)c1C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSV O60911 2/20 0.52
CTSL P07711 2/20 0.52
CTSB P07858 2/20 0.52
CTSS P25774 2/20 0.52
CTSK P43235 2/20 0.52
CTSC P53634 2/20 0.52
CTSF Q9UBX1 2/20 0.52
CTSH P09668 1/20 0.52
ATM Q13315 1/20 0.38
PDE10A Q9Y233 1/20 0.35
HTR1A P08908 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PIK3CD O00329 1/20 0.33

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
SCHEMBL11245488 1.00 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11250765 1.00 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11250731 1.00 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11245479 1.00 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11237393 0.83 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11237384 0.83 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11237386 0.83 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11241262 0.83 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11241271 0.83 CTSV (0.52) CTSVCTSLCTSBCTSSCTSK
SCHEMBL11248237 0.79 CTSV (0.50) CTSVCTSLCTSBCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4320137-A Derivatives of perhydro-aza-heterocycles CIBA-GEIGY CORPORATION (US) 1982-03-16 US disclosed
US-4246269-A Antidepressant piperidinones CIBA-GEIGY CORPORATION (US) 1981-01-20 US disclosed
US-4160837-A ANTIDEPRESSANTS CIBA-GEIGY CORPORATION (US) 1979-07-10 US disclosed