SCHEMBL28218045

SCHEMBL28218045

C1=CC=CNC=C1.NC(=O)C1=CC=CC=CC1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL27647169 0.89 TSHR (0.35) TSHRMAPK1HSD17B10TDP1
SCHEMBL28256185 0.84 TSHR (0.34) TSHRMAPK1HSD17B10TDP1
SCHEMBL8333628 0.80
SCHEMBL27279128 0.79
SCHEMBL28126286 0.72
SCHEMBL11475296 0.70
SCHEMBL7092880 0.70 TSHR (0.41) TSHRMAPK1HSD17B10TDP1
SCHEMBL26215923 0.69
SCHEMBL28299873 0.68
Carbamic Acid SCHEMBL27422028 0.66 ACHE (0.44)

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
CN-108026325-A Daiamid composition with improved optical property 巴斯夫欧洲公司 2018-05-11 CN disclosed