SCHEMBL9305643

SCHEMBL9305643

CC1CC2OC2CC1C(=O)OC1(C2(OC(=O)C3CC4OC4CC3C)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPP5C P53041 1/20 0.33
SCN1A P35498 1/20 0.32
SCN2A Q99250 1/20 0.32
SCN3A Q9NY46 1/20 0.32

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
SCHEMBL6691422 0.80
SCHEMBL2318293 0.78 PPM1B (0.43) PPP5C
SCHEMBL14828626 0.78 PPM1B (0.43) PPP5C
SCHEMBL28761315 0.77 SCN1A (0.35) SCN1ASCN2ASCN3A
SCHEMBL11275427 0.75 PPM1B (0.39) PPP5C
SCHEMBL1717660 0.75 PPP5C (0.34) PPP5C
SCHEMBL2320405 0.74 PPM1B (0.47)
SCHEMBL693235 0.71 PPP5C (0.48) PPP5C
SCHEMBL1648856 0.71 PPP5C (0.48) PPP5C
SCHEMBL259149 0.71 ALDH1A1 (0.35) PPP5C

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
US-5330820-A Fiber network ALLIEDSIGNAL INC. (US) 1994-07-19 US disclosed