SCHEMBL11760490

SCHEMBL11760490

Nc1nc(NCc2ccccc2)[nH]c(=O)c1N

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 1/20 0.60
▸ HPGD P15428 2/20 0.56
▸ PKM P14618 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ PI4KA P42356 2/20 0.55
▸ PI4K2B Q8TCG2 2/20 0.55
▸ PI4K2A Q9BTU6 2/20 0.55
▸ PI4KB Q9UBF8 2/20 0.55
▸ RECQL P46063 1/20 0.54
▸ XDH P47989 1/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ TP53 P04637 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ FABP4 P15090 1/20 0.50

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
SCHEMBL6359272 0.77 PNP (0.92) PNPHPGDPKML3MBTL1PI4KA
SCHEMBL11680789 0.76 MAPT (0.54) HPGDL3MBTL1MEN1KMT2ALMNA
SCHEMBL24725165 0.76 APP (0.50) PNPPI4KAPI4K2BPI4K2API4KB
SCHEMBL3304711 0.76 PNP (0.60) PNPHPGDPKML3MBTL1PI4KA
SCHEMBL11678932 0.76 PNP (0.60) PNPMEN1KMT2AMAPT
SCHEMBL4321719 0.74 KDM4C (0.45) PNPHPGDL3MBTL1XDHMEN1
SCHEMBL2623142 0.72 HPGD (0.52) PNPHPGDPKML3MBTL1RECQL
SCHEMBL27743966 0.72 HPGD (0.52) PNPHPGDPKML3MBTL1RECQL
Hydrochloric Acid SCHEMBL5478228 0.72 APP (0.67) PKMKMT2ALMNAALDH1A1MAPT
SCHEMBL6356976 0.71 PNP (0.70) PNPHPGDPKML3MBTL1PI4KA

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-4043750-A OXIDATION HENKEL & CIE GMBH (DT) 1977-08-23 — — US disclosed
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