SCHEMBL20082196

SCHEMBL20082196

CC(C)/C(C=O)=C/N(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 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
SCHEMBL2413037 1.00 TSHR (0.33) TSHR
SCHEMBL2413039 1.00 TSHR (0.33) TSHR
SCHEMBL9785548 0.73
SCHEMBL9785552 0.73
SCHEMBL9785545 0.73
SCHEMBL21097401 0.72
SCHEMBL17750780 0.71
SCHEMBL3363400 0.71
SCHEMBL3363405 0.71
SCHEMBL14293416 0.69

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-3312161-A1 METHOD FOR PREPARING PYRAZOLECARBOXYLIC ACID DERIVATIVE, AND INTERMEDIATE THEREOF Zhejiang Yongtai Technology Co., Ltd. (CN) 2018-04-25 EP disclosed