SCHEMBL20070416

SCHEMBL20070416

C/C=C/c1cccnc1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TRIM24 O15164 1/20 0.35
▸ TRIM33 Q9UPN9 1/20 0.35
▸ FGF23 Q9GZV9 1/20 0.35
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ IDO1 P14902 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ERN1 O75460 1/20 0.33
▸ APP P05067 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 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
SCHEMBL7216828 0.83 — —
SCHEMBL9000389 0.78 KDM4E (0.37) KDM4ENPC1RAB9AMAPTGAA
SCHEMBL12335685 0.77 NPC1 (0.40) KDM4ENPC1RAB9AMAPTGAA
SCHEMBL17531171 0.77 APLNR (0.38) KDM4ENPC1RAB9AMAPTTRIM24
SCHEMBL22002051 0.77 FGF23 (0.42) KDM4ENPC1RAB9AMAPTTRIM24
SCHEMBL11965841 0.77 APLNR (0.38) KDM4ENPC1RAB9AMAPTTRIM24
SCHEMBL10072090 0.75 NOS3 (0.48) KDM4ENPC1RAB9AMAPTGAA
SCHEMBL20347735 0.75 NOS3 (0.48) KDM4ENPC1RAB9AMAPTGAA
SCHEMBL3439424 0.74 — —
SCHEMBL5809339 0.74 — —

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-2018071447-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 — — WO disclosed
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