SCHEMBL5959941

SCHEMBL5959941

CCC#CCCCCCCCCCSC

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 5/20 0.39
RAB9A P51151 1/20 0.36
PTPN7 P35236 3/20 0.33
HMGCR P04035 1/20 0.33
RECQL P46063 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL31336402 0.82 RAB9A (0.48) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL12367017 0.79
SCHEMBL16287812 0.79 TRPA1 (0.38) TRPA1RAB9A
SCHEMBL16287665 0.79 TRPA1 (0.38) TRPA1RAB9A
SCHEMBL16288752 0.79 TRPA1 (0.38) TRPA1RAB9A
SCHEMBL5959946 0.79 TSHR (0.35) RAB9APTPN7HMGCR
SCHEMBL3621240 0.79 RAB9A (0.43) RAB9APTPN7HMGCRRECQLTDP1
SCHEMBL1016933 0.78 TRPA1 (0.40) TRPA1RAB9A
SCHEMBL4466973 0.78 TRPA1 (0.40) TRPA1RAB9A
SCHEMBL16288612 0.76 TRPA1 (0.35) TRPA1RAB9A

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-8178713-B2 Sulfur-containing phospholipid derivatives Pronovo Biopharma Norge AS (NO) 2012-05-15 US disclosed