SCHEMBL22061567

SCHEMBL22061567

CC12CCCN1c1nc(Cl)ccc1C(=O)N2

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 3/20 0.36
PRKCQ Q04759 3/20 0.36
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 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
SCHEMBL22061568 0.73 MKNK1 (0.43)
SCHEMBL22061569 0.71 MKNK2 (0.43) PRKCAPRKCQ
Hydrochloric Acid SCHEMBL30662588 0.70 MKNK2 (0.42) PRKCAPRKCQ
SCHEMBL29361608 0.66 TDP2 (0.35)
SCHEMBL14991726 0.66 TDP2 (0.35)
SCHEMBL22367385 0.65 PARP1 (0.42) HTR2AHTR2CHTR2B
SCHEMBL23009999 0.64 PARP1 (0.40)
SCHEMBL30106504 0.64 KDM5A (0.37)
SCHEMBL22061371 0.63 KDM4E (0.33)
SCHEMBL1854333 0.63 PIK3CD (0.57)

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
CN-111253397-A MNK inhibitors 上海迪诺医药科技有限公司 2020-06-09 CN disclosed
WO-2020108619-A1 MNK INHIBITOR 上海迪诺医药科技有限公司 2020-06-04 WO disclosed