SCHEMBL20100221

SCHEMBL20100221

CCC(COCCOC)OC(CN)COC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.33
CYP3A4 P08684 1/20 0.33
DNM1 Q05193 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
SCHEMBL25538614 0.98 HTT (0.33) HTTCYP3A4DNM1
SCHEMBL20100223 0.81
SCHEMBL20100220 0.80
SCHEMBL19638069 0.80 USP2 (0.30)
SCHEMBL17280903 0.77 TSHR (0.32)
SCHEMBL12143452 0.76 DNM1 (0.41) HTTDNM1
SCHEMBL27466717 0.76 PRKD3 (0.39) CYP3A4
SCHEMBL20100222 0.75
SCHEMBL16854579 0.74 CYP3A4 (0.36) HTTCYP3A4DNM1
SCHEMBL27339947 0.74 PRKD3 (0.38) CYP3A4

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-20180117538-A1 POLYACID-FUNCTIONALIZED POROUS MEMBRANES, RELATED METHODS, AND RELATED POLYACID POLYMERS BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2018-05-03 US disclosed