SCHEMBL10995751

SCHEMBL10995751

CC(C)C1CCC(C(C)C)C1C1CCCCC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.37
UGT2B7 P16662 2/20 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
SCHEMBL4164197 0.72 GAA (0.31) UGT2B7
SCHEMBL20585982 0.67 ALDH1A1 (0.38)
SCHEMBL23308952 0.64 ALDH1A1 (0.35) UGT2B7
SCHEMBL1237248 0.64 ALDH1A1 (0.35) UGT2B7
SCHEMBL28655951 0.64 ALDH1A1 (0.35) UGT2B7
SCHEMBL7885821 0.64 GAA (0.31)
SCHEMBL29151007 0.64 GAA (0.31)
SCHEMBL21131566 0.63
SCHEMBL12166892 0.63 TRPA1 (0.42) PTPN1UGT2B7
SCHEMBL14900257 0.63

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-4517379-A ARTIFICIAL SWEETENER PFIZER INC. (US) 1985-05-14 US disclosed
US-4454328-A SWEETENERS PFIZER INC. (US) 1984-06-12 US disclosed
US-4399163-A ARTIFICIAL SWEETENERS PFIZER INC. (US) 1983-08-16 US disclosed