SCHEMBL30107133

SCHEMBL30107133

CN(C)C(=O)C(C)(C)n1cccn1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.36
HDAC1 Q13547 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
LMNA P02545 1/20 0.32
MGLL Q99685 1/20 0.31
ELANE P08246 1/20 0.31
ADRB3 P13945 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
SCHEMBL3095800 0.82 LMNA (0.47) KMT2ALMNAELANEADRB3
SCHEMBL16886284 0.80 KCNN4 (0.34) ELANEADRB3
SCHEMBL10473438 0.78 ELANE (0.33) KMT2ALMNAELANEADRB3
SCHEMBL26668633 0.76 NOS1 (0.38) KMT2AELANEADRB3
SCHEMBL26668132 0.74 KCNN4 (0.34) ELANEADRB3
SCHEMBL16422823 0.74 ELANE (0.32) ELANEADRB3
SCHEMBL30107368 0.73 ADRB3 (0.37) ELANEADRB3
SCHEMBL16867683 0.71 NOS1 (0.45)
SCHEMBL18704852 0.70 LMNA (0.33) LMNA
SCHEMBL3372959 0.70

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
CN-110678466-B Diazanaphthalenes as HPK1 inhibitors 豪夫迈·罗氏有限公司 2023-01-31 CN disclosed