SCHEMBL7769415

SCHEMBL7769415

CCn1cc(O)c(C)c(C#N)c1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.43
ALDH1A1 P00352 5/20 0.43
MAPK1 P28482 3/20 0.43
LMNA P02545 1/20 0.42
MAPT P10636 6/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
TSHR P16473 1/20 0.37
CASP1 P29466 1/20 0.37
HSD17B10 Q99714 1/20 0.37
USP2 O75604 1/20 0.37
THRB P10828 1/20 0.37
TYR P14679 1/20 0.36

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
SCHEMBL11211118 0.87 TYR (0.47) KDM4EALDH1A1MAPK1LMNAMAPT
SCHEMBL11211380 0.84 TYR (0.50) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL11214719 0.84 KDM4E (0.48) KDM4EALDH1A1MAPK1LMNAMAPT
SCHEMBL11131096 0.82 TYR (0.44) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL11216542 0.82 TYR (0.44) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL11208013 0.82 TYR (0.44) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL8821197 0.78 ALDH1A1 (0.47) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL621548 0.78 KDM4E (0.39) KDM4EALDH1A1MAPK1LMNAMAPT
SCHEMBL11212583 0.77 KDM4E (0.45) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL7773778 0.75 KDM4E (0.38) KDM4EALDH1A1MAPK1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0776948-B1 Mixtures of pyridone monoazo dyestuffs CIBA SC HOLDING AG (CH) 2001-08-01 EP disclosed
EP-0776948-A1 Mixtures of pyridone monoazo dyestuffs Ciba SC Holding AG (CH) 1997-06-04 EP disclosed
EP-0297397-B1 PREPARATION OF DIAZO AND AZO COMPOUNDS BAYER AG (DE) 1993-08-04 EP disclosed
US-4942225-A Preparation of diazo and azo compounds using azidoformamidium salts BAYER AKTIENGESELLSCHAFT (DE) 1990-07-17 US disclosed
EP-0297397-A2 Preparation of diazo and azo compounds BAYER AG (DE) 1989-01-04 EP disclosed