SCHEMBL28523716

SCHEMBL28523716

CCNC(=O)c1cccc(Nc2nccc(-c3ccc(NC(=O)[C@@H]4CC4(F)F)nc3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.49
SRC P12931 7/20 0.49
EGFR P00533 1/20 0.49
BCR P11274 9/20 0.49
CDC7 O00311 1/20 0.48
CDK19 Q9BWU1 1/20 0.48
PDGFRB P09619 6/20 0.46
PDGFRA P16234 6/20 0.46
PRKCA P17252 5/20 0.46
PRKCD Q05655 4/20 0.46
JAK2 O60674 2/20 0.45
PRKD3 O94806 1/20 0.45
PRKCG P05129 1/20 0.45
PRKCB P05771 1/20 0.45
PRKCH P24723 1/20 0.45
PRKCI P41743 1/20 0.45
PRKCE Q02156 1/20 0.45
PRKCQ Q04759 1/20 0.45
PRKCZ Q05513 1/20 0.45
PRKD1 Q15139 1/20 0.45

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
SCHEMBL26662097 0.90 JAK2 (0.47) CDC7CDK19JAK2PRKD3CDK2
SCHEMBL25346221 0.86 JAK2 (0.49) ABL1BCRCDC7CDK19PDGFRB
SCHEMBL25346211 0.86 JAK2 (0.49) ABL1BCRCDC7CDK19PDGFRB
SCHEMBL26850819 0.82 JAK2 (0.53) CDC7CDK19JAK2PRKD3CDK2
SCHEMBL24300848 0.78 JAK2 (0.51) ABL1CDC7CDK19JAK2CDK2
SCHEMBL26850833 0.78 JAK2 (0.51) ABL1CDC7CDK19JAK2CDK2
SCHEMBL23275729 0.77 JAK2 (0.55) EGFRJAK2JAK3
SCHEMBL29713627 0.77 JAK2 (0.55) EGFRJAK2JAK3
SCHEMBL29901242 0.77 JAK2 (0.55) EGFRJAK2JAK3
SCHEMBL29901156 0.77 JAK2 (0.55) EGFRJAK2JAK3

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-112142675-B Small molecule compound as JAK kinase inhibitor and application thereof 嘉兴特科罗生物科技有限公司 2021-11-30 CN disclosed
CN-112142675-A Small molecule compound as JAK kinase inhibitor and application thereof 嘉兴特科罗生物科技有限公司 2020-12-29 CN disclosed