SCHEMBL14670940

SCHEMBL14670940

C=C(C)C(=O)OCC1CC2CC(C)CC(C1)C2

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
TSHR P16473 3/20 0.38
THRB P10828 1/20 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
SCHEMBL2783842 0.84 ALDH1A1 (0.60) ALDH1A1TSHRTHRB
SCHEMBL23493801 0.82 ALDH1A1 (0.55) ALDH1A1TSHRTHRB
SCHEMBL23494083 0.78 ALDH1A1 (0.50) ALDH1A1TSHRTHRB
SCHEMBL465384 0.77 ALDH1A1 (0.53) ALDH1A1TSHRTHRB
SCHEMBL496421 0.76 ALDH1A1 (0.60) ALDH1A1TSHRTHRB
SCHEMBL12269715 0.76 ALDH1A1 (0.60) ALDH1A1TSHRTHRB
SCHEMBL465417 0.76 ALDH1A1 (0.51) ALDH1A1TSHRTHRB
SCHEMBL1061355 0.76 ALDH1A1 (0.51) ALDH1A1TSHRTHRB
SCHEMBL14276056 0.76 ALDH1A1 (0.56) ALDH1A1TSHRTHRB
SCHEMBL19487114 0.76 ALDH1A1 (0.56) ALDH1A1TSHRTHRB

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
WO-2013015125-A1 PHOTOCURABLE INK JET INK AND ELECTRONIC CIRCUIT BOARD JNC株式会社 (JP) 2013-01-31 WO disclosed