SCHEMBL22698103

SCHEMBL22698103

C=C(N)/C=C/CCC(C)C

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
MAPT P10636 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
SCHEMBL22698148 0.84 ALDH1A1 (0.40) ALDH1A1MAPT
SCHEMBL11860745 0.79 TSHR (0.31)
SCHEMBL11860741 0.79 TSHR (0.31)
SCHEMBL13084532 0.78
SCHEMBL16134041 0.77 ALDH1A1 (0.44) ALDH1A1MAPT
SCHEMBL19148976 0.77 ALDH1A1 (0.44) ALDH1A1MAPT
SCHEMBL13892801 0.73
SCHEMBL7695171 0.71
SCHEMBL23077899 0.71
SCHEMBL2840987 0.71 LMNA (0.35)

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-2020236621-A1 ASCAROSIDE DERIVATIVES AND METHODS OF USE CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2020-11-26 WO disclosed