SCHEMBL10077077

SCHEMBL10077077

C=C(C)C(=O)OC(CNCOC)CNCOC

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.43
TSHR P16473 3/20 0.36
THRB P10828 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
SCHEMBL20202281 0.79 ALDH1A1 (0.46) ALDH1A1TSHRTHRB
SCHEMBL14546264 0.75 TSHR (0.47) ALDH1A1TSHRTHRB
SCHEMBL20224592 0.74 ALDH1A1 (0.41) ALDH1A1TSHRTHRB
SCHEMBL20458684 0.73 ALDH1A1 (0.40) ALDH1A1TSHR
SCHEMBL20224599 0.71 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL17947770 0.70 TSHR (0.42) ALDH1A1TSHRTHRB
SCHEMBL440616 0.70 TSHR (0.45) ALDH1A1TSHRTHRB
SCHEMBL35385 0.70 TSHR (0.45) ALDH1A1TSHRTHRB
SCHEMBL12808955 0.69 TSHR (0.55) ALDH1A1TSHRTHRB
SCHEMBL18440282 0.69 THRB (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
EP-2412733-A1 Polymer, chemically amplified negative resist composition, and patterning process Shin-Etsu Chemical Co., Ltd. (JP) 2012-02-01 EP disclosed