SCHEMBL28078636

SCHEMBL28078636

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

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.30

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
SCHEMBL18527055 0.79 TSHR (0.39) TSHRALDH1A1LMNA
SCHEMBL5698301 0.77 TSHR (0.37) TSHRALDH1A1LMNA
SCHEMBL17598953 0.75 TSHR (0.36) TSHRALDH1A1LMNA
SCHEMBL1426751 0.73 LMNA (0.35) TSHRALDH1A1LMNA
SCHEMBL18677617 0.73 ALDH1A1 (0.39) TSHRALDH1A1
SCHEMBL28398261 0.70 TSHR (0.36) TSHRALDH1A1
SCHEMBL3966180 0.70 TSHR (0.38) TSHRALDH1A1
SCHEMBL157071 0.69 TSHR (0.39) TSHRALDH1A1LMNA
SCHEMBL20998428 0.69 TSHR (0.35) TSHR
SCHEMBL5666057 0.69 ALDH1A1 (0.35) TSHRALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105793041-B Original edition of lithographic printing plate and monomer 爱克发有限公司 2018-04-27 CN disclosed
CN-105793041-A A lithographic printing plate precursor and monomer 爱克发印艺公司 2016-07-20 CN disclosed