SCHEMBL20055905

SCHEMBL20055905

O=Cc1cc(N=O)c(OC(F)(F)F)cc1F

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 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
SCHEMBL24517918 0.75 POLB (0.37) —
SCHEMBL24517917 0.75 ERN1 (0.36) —
SCHEMBL15535516 0.72 ALDH1A1 (0.43) EPHX2
SCHEMBL13249652 0.69 EPHX2 (0.39) EPHX2
SCHEMBL248719 0.67 ERN1 (0.50) —
SCHEMBL12061613 0.67 ERN1 (0.31) —
SCHEMBL24181288 0.66 SLC6A4 (0.38) —
SCHEMBL2366445 0.66 PDE2A (0.44) EPHX2
SCHEMBL1220795 0.66 ALDH1A1 (0.40) EPHX2
SCHEMBL2824893 0.66 GPR3 (0.42) EPHX2

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
EP-3083586-B1 NOVEL CARBOXAMIDES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICAL PREPARATIONS COMPRISING THEM, AND USE THEREOF FOR PRODUCING MEDICAMENTS Bayer Pharma AG (DE) 2018-04-18 — — EP disclosed
CN-104507950-B Thienopyrimidines 拜耳医药股份有限公司 2017-03-22 — — CN disclosed
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