SCHEMBL22267237

SCHEMBL22267237

C=C(C)C(=O)OCCC1CC2CC1C1CCC(CCOC(=O)C(=C)C)C21

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.36
TSHR P16473 3/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL21886544 1.00 THRB (0.36) THRBTSHRALDH1A1
SCHEMBL22267296 0.89 THRB (0.36) THRBTSHRALDH1A1
SCHEMBL20819802 0.83 ALDH1A1 (0.43) THRBTSHRALDH1A1
SCHEMBL16378567 0.81 ALDH1A1 (0.35) THRBTSHRALDH1A1
SCHEMBL18831048 0.80 TSHR (0.38) THRBTSHRALDH1A1
SCHEMBL23784436 0.80 THRB (0.37) THRBTSHRALDH1A1
SCHEMBL24167715 0.80 THRB (0.37) THRBTSHRALDH1A1
SCHEMBL21440001 0.78 ALDH1A1 (0.41) THRBTSHRALDH1A1
SCHEMBL23052909 0.76 TSHR (0.32) THRBTSHR
SCHEMBL20727177 0.75

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-10723909-B2 Composition and film TOYO GOSEI CO., LTD. (JP) 2020-07-28 US disclosed