SCHEMBL9309337

SCHEMBL9309337

N#CNNc1ncncn1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSP90AA1 P07900 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
SCHEMBL5029231 0.76 HSP90AA1 (0.42) HSP90AA1
SCHEMBL6208948 0.75
SCHEMBL1031397 0.66
SCHEMBL1644689 0.65 CDK1 (0.34) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL28170532 0.65 ALDH1A1 (0.36) KDM4EALDH1A1LMNAGAAL3MBTL1
SCHEMBL27546347 0.62 PDE4A (0.44) L3MBTL1
SCHEMBL27792660 0.62 HSP90AA1 (0.31) HSP90AA1
SCHEMBL9736081 0.60 TDP1 (0.55) ALDH1A1LMNAGAAL3MBTL1
SCHEMBL9309332 0.60
SCHEMBL1007992 0.60

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-5349057-A Water soluble azo dyes containing a cyanoamino-triazinyl-amino group and a fiber-reactive of the sulfone series HOECHST AKTIENGESELLSCHAFT (DE) 1994-09-20 US disclosed