SCHEMBL11287177

SCHEMBL11287177

CC1=CC2=C(CC1=N)Sc1cc(N)ccc1N2

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ APAF1 O14727 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ NOX1 Q9Y5S8 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
SCHEMBL5698133 0.77 NOX1 (0.33) KDM4EMEN1APAF1GAAMAPT
SCHEMBL12812969 0.71 CA9 (0.33) KDM4EMEN1APAF1GAAMAPT
Hydrochloric Acid SCHEMBL1813065 0.71 KDM4E (0.31) KDM4EMEN1APAF1GAAMAPT
SCHEMBL10593297 0.70 EPHX2 (0.47) KDM4EMEN1GAAMAPTKMT2A
Hydrochloric Acid SCHEMBL1814021 0.70 KDM4E (0.33) KDM4EMEN1APAF1GAAMAPT
SCHEMBL29625245 0.67 SNCA (0.50) KDM4EMEN1APAF1GAAMAPT
SCHEMBL64975 0.67 SNCA (0.50) KDM4EMEN1APAF1GAAMAPT
SCHEMBL29600380 0.67 SNCA (0.50) KDM4EMEN1APAF1GAAMAPT
Hydrochloric Acid SCHEMBL12470954 0.66 SNCA (0.48) KDM4EMEN1APAF1GAAMAPT
Iodide SCHEMBL1206518 0.66 SNCA (0.48) KDM4EMEN1APAF1GAAMAPT

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
US-4338180-A SURFACE-CHALCOGENATED MOLYBENUM OR TUNGSTEN; SOLAR CELLS KURARAY CO., LTD. (JP) 1982-07-06 — — US disclosed
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