SCHEMBL20008337

SCHEMBL20008337

C=CCCN(CC)c1cc(C)cc(Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 1/20 0.43
HTT P42858 1/20 0.42
POLB P06746 1/20 0.33
CRHR1 P34998 2/20 0.32

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
SCHEMBL1425326 0.82 KMT2A (0.59) KDM4EKMT2AHTTPOLBCRHR1
SCHEMBL16454958 0.71 KMT2A (0.41) KDM4EKMT2AHTT
SCHEMBL20008535 0.70 VRK1 (0.31)
SCHEMBL1424847 0.68 KDM4E (0.42) KDM4EKMT2ACRHR1
SCHEMBL1603021 0.67 KMT2A (0.67) KDM4EKMT2AHTTPOLBCRHR1
SCHEMBL9977693 0.66 KMT2A (0.57) KDM4EKMT2A
SCHEMBL24899985 0.65 KDM4E (0.54) KDM4EKMT2AHTTPOLBCRHR1
SCHEMBL12484355 0.65 KMT2A (0.42) KDM4EKMT2AHTTCRHR1
SCHEMBL31511674 0.65 SMN1; SMN2 (0.49) KDM4EKMT2ACRHR1
SCHEMBL5844220 0.65 KDM4E (0.50) KDM4EKMT2AHTTCRHR1

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-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed