SCHEMBL20344448

SCHEMBL20344448

CNC(=O)c1cc(C)n(Cc2ccc(C)cc2)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.69
MEN1 O00255 1/20 0.69
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
NCOR2 Q9Y618 2/20 0.55
PTGER1 P34995 1/20 0.54
MALT1 Q9UDY8 1/20 0.53
BAZ2B Q9UIF8 1/20 0.53
BRD4 O60885 1/20 0.50
P2RY14 Q15391 6/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL24798878 0.85 P2RY14 (0.54) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL1902344 0.84 MEN1 (0.78) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL3095032 0.84 KMT2A (0.62) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL2077298 0.84 MEN1 (0.62) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL3097099 0.83 GAA (0.63) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL1897273 0.83 MEN1 (0.80) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL24798019 0.83 PTGER1 (0.62) KMT2AMEN1PTGER1MALT1BAZ2B
SCHEMBL3093042 0.82 KMT2A (0.61) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL1899756 0.82 MEN1 (1.00) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL18377479 0.82 BAZ2B (0.51) KMT2AMEN1HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3342771-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-11-25 EP disclosed
EP-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed