SCHEMBL28346540

SCHEMBL28346540

O=C1C=Cc2c1cc(Br)cc2C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.30
NOTUM Q6P988 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 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
SCHEMBL28346605 0.78 CES1 (0.34)
SCHEMBL9839461 0.71 CDC25B (0.41)
SCHEMBL27899888 0.70 KDM1A (0.30) KDM1ANOTUM
SCHEMBL29634371 0.69 CDC25B (0.44) NOTUM
SCHEMBL28968222 0.69 CDC25B (0.44) NOTUM
SCHEMBL4555546 0.68 CES1 (0.56)
SCHEMBL15532163 0.66 KDM1A (0.33) KDM1A
SCHEMBL6705993 0.65 KDM1A (0.39) KDM1ANOTUMCA1CA2CA9
SCHEMBL817540 0.64 KDM1A (0.38) KDM1ANOTUM
SCHEMBL29514638 0.63 ROCK1 (0.41) KDM1A

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-106983751-B Bicyclic substituted uracils and their use 拜耳医药股份有限公司 2020-01-07 CN disclosed