SCHEMBL20859523

SCHEMBL20859523

Ic1cnc(N/N=C/c2ccccc2)nc1N1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.56
▸ GAA P10253 4/20 0.52
▸ KDM4E B2RXH2 5/20 0.51
▸ LMNA P02545 2/20 0.51
▸ MAPT P10636 6/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ PIKFYVE Q9Y2I7 4/20 0.48
▸ MAPK1 P28482 3/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ POLB P06746 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ MAOA P21397 1/20 0.45
▸ PIK3CD O00329 1/20 0.44

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
SCHEMBL13548879 0.86 KDM5A (0.74) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL13548880 0.78 LMNA (0.60) GAAKDM4ELMNAMAPTNPC1
SCHEMBL4411464 0.76 GAA (0.72) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL13548872 0.75 GAA (0.70) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL21711070 0.74 KDM5A (0.78) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL19519006 0.73 KDM5A (0.42) KDM5AGAAKDM4EMAPTNPC1
SCHEMBL4407764 0.73 PIKFYVE (0.61) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL13548869 0.73 KDM5A (0.70) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL4411519 0.72 KDM5A (1.00) KDM5AGAAKDM4ELMNAMAPT
SCHEMBL13548881 0.72 KDM5A (0.78) KDM5AGAAKDM4ELMNAMAPT

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
EP-3461813-A1 THERAMUTEIN MODULATORS Housey, Gerard M. (US) 2019-04-03 — — EP disclosed
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