SCHEMBL246319

SCHEMBL246319

C=C(C)C(=O)OCC1OC(F)(F)C1F

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
TSHR P16473 3/20 0.37
THRB P10828 1/20 0.35

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
SCHEMBL245658 0.77 ALDH1A1 (0.47) ALDH1A1TSHRTHRB
SCHEMBL244484 0.76 ALDH1A1 (0.53) ALDH1A1TSHRTHRB
SCHEMBL245220 0.73 ALDH1A1 (0.50) ALDH1A1TSHRTHRB
SCHEMBL245887 0.72 ALDH1A1 (0.57) ALDH1A1TSHRTHRB
SCHEMBL243083 0.72 ALDH1A1 (0.62) ALDH1A1TSHRTHRB
SCHEMBL247210 0.72 ALDH1A1 (0.49) ALDH1A1TSHRTHRB
SCHEMBL20505722 0.72 ALDH1A1 (0.56) ALDH1A1TSHRTHRB
SCHEMBL512480 0.72 ALDH1A1 (0.56) ALDH1A1TSHRTHRB
SCHEMBL29102672 0.72 ALDH1A1 (0.42) ALDH1A1TSHRTHRB
SCHEMBL245629 0.71 ALDH1A1 (0.47) 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
US-20120002138-A1 Pattern forming ink composition, light guide plate, light emitting unit and liquid crystal display element having the light emitting unit CHI-MEI CORPORATION 2012-01-05 US disclosed