SCHEMBL11396595

SCHEMBL11396595

Cn1c(-c2n[nH]c(=O)[nH]2)nc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 9/20 0.52
▸ ALDH1A1 P00352 9/20 0.52
▸ MAPT P10636 4/20 0.52
▸ THRB P10828 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ PDGFRB P09619 1/20 0.49
▸ FGFR1 P11362 1/20 0.49
▸ HPGD P15428 4/20 0.49
▸ GAA P10253 3/20 0.49
▸ POLB P06746 1/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ BTK Q06187 2/20 0.49
▸ RAB9A P51151 7/20 0.48
▸ NPC1 O15118 6/20 0.48
▸ PKM P14618 5/20 0.48
▸ TP53 P04637 4/20 0.48
▸ HSD17B10 Q99714 3/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ SMN1; SMN2 Q16637 5/20 0.47

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
SCHEMBL1171430 0.76 MEN1 (0.69) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL15886674 0.75 MEN1 (0.51) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL230069 0.75 NPC1 (0.56) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL15886668 0.74 MEN1 (0.50) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL8927008 0.74 KDM4E (0.51) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL20982597 0.71 ALDH1A1 (0.83) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL6016075 0.70 MEN1 (0.49) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL3476023 0.70 GSR (0.65) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL21318393 0.70 PDGFRB (0.52) KDM4EALDH1A1MAPTTHRBL3MBTL1
SCHEMBL517706 0.70 MEN1 (0.77) KDM4EALDH1A1MAPTTHRBL3MBTL1

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-4269846-A BENZOHETEROCYCLIC OXADIAZOLONES AND TRIAZOLONES USV PHARMACEUTICAL CORPORATION (US) 1981-05-26 — — US disclosed
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