SCHEMBL28046751

SCHEMBL28046751

Cn1ncc(OC=O)c1C(F)F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 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
SCHEMBL27956205 0.75 CFD (0.33)
SCHEMBL1013267 0.75 ITGA4 (0.32)
SCHEMBL19912814 0.74 KDM4C (0.37) HIF1A
SCHEMBL31595785 0.73 HIF1A (0.33) HIF1A
SCHEMBL1012752 0.69 KMT2A (0.39)
SCHEMBL13057196 0.67 CYP11B2 (0.31)
SCHEMBL26803600 0.67 ACHE (0.33) HIF1A
SCHEMBL24178942 0.66 ACHE (0.31)
SCHEMBL21893804 0.66 PI4KA (0.33)
SCHEMBL21292266 0.66 HTT (0.38)

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-105218448-B A kind of synthetic method of the pyrazole carboxylic acid of 1 methyl, 3 difluoromethyl 4 江苏恒润制药有限公司 2017-11-07 CN disclosed
CN-105218448-A A kind of synthetic method of 1-methyl-3-difluoromethyl-4-pyrazole carboxylic acid Jiangsu hengrun pharmaceutical co ltd 2016-01-06 CN disclosed