SCHEMBL28294566

SCHEMBL28294566

CC(C)CC=COC(=O)OC=CCC(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL27260984 0.84 TSHR (0.33) TSHR
SCHEMBL3009070 0.80 TSHR (0.32) TSHR
SCHEMBL3009209 0.80 TSHR (0.32) TSHR
SCHEMBL28453690 0.80
SCHEMBL28377001 0.77
SCHEMBL15005515 0.73 TSHR (0.32) TSHR
SCHEMBL153167 0.72 ALDH1A1 (0.38) TSHR
SCHEMBL1598830 0.72 ALDH1A1 (0.38) TSHR
SCHEMBL11767585 0.72
Propionic Acid SCHEMBL28151518 0.71 FFAR3 (0.42)

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
CN-109694302-A Using the method for the selection of load four raffinate of raney copper catalyst carbon plus hydrogen butylene of Ag doping 中国石油化工股份有限公司 2019-04-30 CN disclosed