SCHEMBL11638331

SCHEMBL11638331

CC1(CC(=O)O)CCC=CO1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP2C19 P33261 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
SCHEMBL10943340 0.76
SCHEMBL11638145 0.73
SCHEMBL11637571 0.73 ALDH1A1 (0.31) ALDH1A1CYP2C19
SCHEMBL11640969 0.72
SCHEMBL11640096 0.71 FFAR3 (0.36) TSHR
SCHEMBL17916103 0.71 FFAR3 (0.36) TSHR
SCHEMBL11635034 0.70
SCHEMBL11637374 0.69
SCHEMBL8063962 0.69 L3MBTL1 (0.36) TSHRL3MBTL1ALDH1A1
SCHEMBL11639544 0.69 L3MBTL1 (0.36) TSHRL3MBTL1ALDH1A1

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-4107289-A Use of substituted pyrans as deodorant chemicals NAARDEN INTERNATIONAL HOLLAND, B.V. (NL) 1978-08-15 US disclosed