SCHEMBL22157658

SCHEMBL22157658

CCCCCCCC1(c2ccccc2C[C@@H](C)CC)C=CC(C(=O)O)C=C1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 8/20 0.34
CYSLTR1 Q9Y271 8/20 0.34
USP2 O75604 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
SCHEMBL20594580 1.00 CYSLTR2 (0.34) CYSLTR2CYSLTR1USP2
SCHEMBL20594623 1.00 CYSLTR2 (0.34) CYSLTR2CYSLTR1USP2
SCHEMBL20594531 0.91
SCHEMBL9511141 0.85 CYSLTR2 (0.43) CYSLTR2CYSLTR1
SCHEMBL9247767 0.85 CYSLTR2 (0.45) CYSLTR2CYSLTR1
SCHEMBL9155406 0.85 CYSLTR2 (0.45) CYSLTR2CYSLTR1
SCHEMBL11135660 0.85 CYSLTR2 (0.45) CYSLTR2CYSLTR1
SCHEMBL9755589 0.85 CYSLTR2 (0.40) CYSLTR2CYSLTR1
SCHEMBL5666120 0.84 CYSLTR2 (0.41) CYSLTR2CYSLTR1
SCHEMBL20594627 0.84 CYSLTR2 (0.43) CYSLTR2CYSLTR1

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-20200206096-A1 Chromic Compositions TheUnseen Limited (GB) 2020-07-02 US disclosed