SCHEMBL10557002

SCHEMBL10557002

CCCCCCCCC(C)c1ccccc1CO

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 7/20 0.43
CYSLTR1 Q9Y271 7/20 0.43
LIPG Q9Y5X9 1/20 0.41
CSNK1E P49674 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.37
SOAT1 P35610 1/20 0.37
PPARG P37231 2/20 0.36

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
SCHEMBL6679577 0.86 CYSLTR2 (0.46) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL17027717 0.85 CYSLTR2 (0.41) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL17027726 0.85 CYSLTR2 (0.41) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL17027756 0.85 CYSLTR2 (0.41) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL17027746 0.85 CYSLTR2 (0.41) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL17027712 0.85 CYSLTR2 (0.41) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL17027796 0.85 CYSLTR2 (0.41) CYSLTR2CYSLTR1LIPGCSNK1EALDH1A1
SCHEMBL6682255 0.84 CYSLTR2 (0.43) CYSLTR2CYSLTR1LIPGALDH1A1TSHR
SCHEMBL6684349 0.84 CSNK1E (0.42) CYSLTR2CYSLTR1CSNK1EALDH1A1TSHR
SCHEMBL6678854 0.82 TSHR (0.43) CYSLTR2CYSLTR1CSNK1EALDH1A1TSHR

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-4883614-A TREATMENT OF RHEUMATOID ARTHRITIS, IMMUNOSUPPRESSANTS HOFFMAN-LA ROCHE INC. (US) 1989-11-28 US disclosed