SCHEMBL18379038

SCHEMBL18379038

O=CNCc1ncc(Cl)cc1Br

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.36
▸ ERN1 O75460 1/20 0.32
▸ ADH1B P00325 1/20 0.32
▸ ADH1C P00326 1/20 0.32
▸ ADH1A P07327 1/20 0.32
▸ ADH7 P40394 1/20 0.32

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
SCHEMBL18379215 0.83 KMT2A (0.38) ADH1BADH1CADH1AADH7
SCHEMBL18379081 0.79 PLAU (0.40) PLAU
SCHEMBL16722630 0.77 PLAU (0.36) PLAUADH1BADH1CADH1AADH7
SCHEMBL30461483 0.73 ADH1B (0.32) ADH1BADH1CADH1AADH7
SCHEMBL25262321 0.73 ADH1B (0.32) ADH1BADH1CADH1AADH7
SCHEMBL30481308 0.72 PLAU (0.43) PLAU
SCHEMBL25224414 0.72 PLAU (0.43) PLAU
SCHEMBL20188949 0.72 PLAU (0.43) PLAU
SCHEMBL23706067 0.72 PLAU (0.43) PLAU
SCHEMBL31091988 0.72 PLAU (0.43) PLAU

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
WO-2017007700-A1 PHARMACEUTICAL COMPOUND IOMET PHARMA LTD. (GB) 2017-01-12 — — WO disclosed
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