SCHEMBL7478571

SCHEMBL7478571

CC(CN)C1CCC2(CC1)OCCO2

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL30666567 0.81 CTSS (0.31) CTSSCTSKSMN1; SMN2
SCHEMBL30666988 0.81 TRPV3 (0.36) CTSSCTSKSMN1; SMN2
Bromide SCHEMBL30666412 0.79 CTSS (0.30) CTSSCTSK
SCHEMBL23581343 0.78 CTSS (0.30) CTSSCTSK
SCHEMBL8275624 0.77 CTSS (0.31) CTSSCTSKSMN1; SMN2
SCHEMBL10598028 0.75 ALDH1A1 (0.40)
SCHEMBL2200088 0.74 SMN1; SMN2 (0.35) CTSSCTSKSMN1; SMN2
SCHEMBL1678475 0.73
SCHEMBL12033840 0.73 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL22183962 0.73 PIK3CD (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937708-B1 Sulphonamide derivatives LILLY CO ELI (US) 2002-12-18 EP disclosed
US-6362230-B1 ALZHEIMER'S DISEASE ELI LILLY AND COMPANY 2002-03-26 US disclosed
US-6174922-B1 FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION IN WARM BLOODED MAMMAL ELI LILLY AND COMPANY 2001-01-16 US disclosed
EP-0937708-A2 sulphonamide derivatives ELI LILLY AND COMPANY (US) 1999-08-25 EP disclosed