SCHEMBL27646346

SCHEMBL27646346

C=CC(=O)OC(CC)CCCCCCC(C)C.O=C(O)C1CCC(C(=O)O)CC1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33

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
SCHEMBL27626010 0.96 TSHR (0.34) TSHR
SCHEMBL27646381 0.91 TSHR (0.35) TSHR
SCHEMBL27626043 0.91 TSHR (0.35) TSHR
SCHEMBL27646420 0.91 TSHR (0.35) TSHR
SCHEMBL27646431 0.91 TSHR (0.40) TSHR
SCHEMBL28758549 0.91 TSHR (0.40) TSHR
SCHEMBL27625995 0.90 EPHX2 (0.35) TSHR
SCHEMBL27646389 0.90 TSHR (0.35) TSHR
SCHEMBL27626093 0.89 EPHX2 (0.36) TSHR
SCHEMBL27646429 0.88 TSHR (0.42) TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101410646-A Torque limiter JTEKT CORP (JP) 2009-04-15 CN disclosed
CN-1784203-A Cosmetic composition containing cyclohexane polycarboxylic acid derivative BASF AG (DE) 2006-06-07 CN disclosed