SCHEMBL9685603

SCHEMBL9685603

Nc1ccc2nc(O)c(N)c(N)c2c1N

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL9534423 0.72 MAPT (0.39) MEN1LMNAHSP90AA1HSP90AB1MAPT
Hydrochloric Acid SCHEMBL11047993 0.71 MAPT (0.38) MEN1LMNAHSP90AA1HSP90AB1MAPT
SCHEMBL8348805 0.68 DHFR (0.46)
SCHEMBL8725693 0.64 ALDH1A1 (0.64) LMNAMAPTHTTKMT2AHIF1A
SCHEMBL10369590 0.63 CYP3A4 (0.37) MEN1LMNAHSP90AA1HSP90AB1MAPT
SCHEMBL29463764 0.63 CYP3A4 (0.37) MEN1LMNAHSP90AA1HSP90AB1MAPT
SCHEMBL11211809 0.61 MEN1 (0.37) MEN1LMNAMAPTBLMKMT2A
SCHEMBL29429655 0.60 ALDH1A1 (0.45) MEN1MAPTKMT2A
SCHEMBL10348834 0.59 MAPT (0.52) MEN1LMNAMAPTHTTBLM
SCHEMBL30530989 0.59 EP300 (0.44) MEN1LMNAHSP90AA1HSP90AB1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0273176-B1 FUSED HETEROCYCLIC TETRAHYDROAMINOQUINOLINOLS AND RELATED COMPOUNDS, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-06-24 EP disclosed
EP-0273176-A2 Fused heterocyclic tetrahydroaminoquinolinols and related compounds, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-07-06 EP disclosed
US-4753950-A MEMORY ENHANCEMENT, ALZHEIMER*S DISEASE HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1988-06-28 US disclosed