SCHEMBL11228906

SCHEMBL11228906

CNCCn1c(O)cc(C)c(C#N)c1=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.51
USP2 O75604 1/20 0.51
LMNA P02545 4/20 0.50
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
MAPT P10636 4/20 0.46
HPGD P15428 1/20 0.46
THRB P10828 2/20 0.43
HSD17B10 Q99714 3/20 0.43
ALDH1A1 P00352 4/20 0.43
MAPK1 P28482 1/20 0.43
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL17949841 0.87 KDM4E (0.60) KDM4EUSP2LMNAMEN1KMT2A
Dimethylamine SCHEMBL11340686 0.85 KDM4E (0.68) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL7893080 0.84 KDM4E (0.48) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL8381050 0.84 KDM4E (0.51) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL10766144 0.84 KDM4E (0.57) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL10769714 0.84 KDM4E (0.57) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL11235930 0.83 KDM4E (0.47) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL9013722 0.83 KDM4E (0.53) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL10768477 0.83 KDM4E (0.56) KDM4EUSP2LMNAMEN1KMT2A
SCHEMBL11423461 0.83 KDM4E (0.33) KDM4EUSP2MEN1KMT2AMAPT

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-4327018-A Azo dyes and the production and use thereof CIBA-GEIGY CORPORATION (US) 1982-04-27 US disclosed