SCHEMBL28198387

SCHEMBL28198387

NC=S.Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)nn1-c1c(F)cccc1F

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNB2 O95067 8/20 0.61
▸ CDK1 P06493 8/20 0.61
▸ CCNB1 P14635 8/20 0.61
▸ CCNB3 Q8WWL7 8/20 0.61
▸ JAK2 O60674 8/20 0.61
▸ EIF2AK2 P19525 3/20 0.61
▸ AURKA O14965 3/20 0.61
▸ CDK4 P11802 2/20 0.61
▸ CCNA2 P20248 2/20 0.61
▸ CCND1 P24385 2/20 0.61
▸ CDK2 P24941 2/20 0.61
▸ MAPK3 P27361 2/20 0.61
▸ MAPK1 P28482 2/20 0.61
▸ KDR P35968 2/20 0.61
▸ CSNK1A1 P48729 2/20 0.61
▸ CSNK1D P48730 2/20 0.61
▸ CSNK1E P49674 2/20 0.61
▸ CLK1 P49759 2/20 0.61
▸ CLK3 P49761 2/20 0.61
▸ GSK3A P49840 2/20 0.61

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
SCHEMBL21067547 0.94 CCNB2 (0.67) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL27691113 0.81 JAK2 (0.55) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL5964775 0.76 CCNB2 (0.64) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL24339601 0.76 JAK2 (1.00) CCNB2CDK1CCNB1CCNB3JAK2
Jnj-7706621 SCHEMBL1060773 0.76 CDK1 (1.00) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL1394721 0.75 CCNB2 (1.00) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL5726628 0.74 JAK2 (0.70) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL5726633 0.74 JAK2 (0.70) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL4037297 0.74 CCNB2 (0.70) CCNB2CDK1CCNB1CCNB3JAK2
SCHEMBL5964695 0.74 CCNB2 (1.00) CCNB2CDK1CCNB1CCNB3JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102272291-B Differentiation of human embryonic stem cells into the pancreatic endocrine lineage 詹森生物科技公司 2018-01-16 — — CN claimed
CN-107904201-A Differentiation of the human embryo stem cell to pancreatic endocrine pedigree 詹森生物科技公司 2018-04-13 — — CN disclosed
CN-102272291-B Differentiation of human embryonic stem cells into the pancreatic endocrine lineage 詹森生物科技公司 2018-01-16 — — CN disclosed
Send feedback