SCHEMBL8963929

SCHEMBL8963929

C=Cc1cncc(C(=O)c2cccc(N3CCCN(C(=O)OC(C)(C)C)CC3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 2/20 0.51
SKP1 P63208 2/20 0.51
SKP2 Q13309 2/20 0.51
PDE10A Q9Y233 1/20 0.40
HSD17B14 Q9BPX1 2/20 0.40
MAP4K4 O95819 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TGM2 P21980 1/20 0.39
GBA1 P04062 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
EGFR P00533 3/20 0.38
GALR2 O43603 1/20 0.38
GALR1 P47211 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
PRKCQ Q04759 1/20 0.37

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
SCHEMBL8963158 0.88 CKS1B (0.55) CKS1BSKP1SKP2PDE10AHSD17B14
SCHEMBL8963540 0.86 CKS1B (0.60) CKS1BSKP1SKP2PDE10AHSD17B14
SCHEMBL8963893 0.84 CKS1B (0.54) CKS1BSKP1SKP2PDE10AHSD17B14
SCHEMBL13857199 0.84 CKS1B (0.51) CKS1BSKP1SKP2PDE10AMAP4K4
SCHEMBL8963921 0.84 CKS1B (0.51) CKS1BSKP1SKP2PDE10AHSD17B14
SCHEMBL8963114 0.84 CKS1B (0.55) CKS1BSKP1SKP2PDE10AHSD17B14
SCHEMBL8970047 0.84 CKS1B (0.51) CKS1BSKP1SKP2PDE10AMAP4K4
SCHEMBL8964879 0.83 HSD17B14 (0.53) HSD17B14PIM2PRKCQ
SCHEMBL8963912 0.83 CKS1B (0.52) CKS1BSKP1SKP2PDE10AHSD17B14
SCHEMBL8964441 0.82 HSD17B14 (0.42) HSD17B14PIM2PRKCQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140221334-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-08-07 US disclosed
US-8741931-B2 Kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED 2014-06-03 US disclosed
US-20120214799-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-08-23 US disclosed
US-8188071-B2 Amino substituted pyridines as potent kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-20090124602-A1 KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED 2009-05-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140221334-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 CKS1B 137/4885SKP1 386/4885SKP2 219/4885
US-20120214799-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 CKS1B 137/4885SKP1 386/4885SKP2 219/4885
US-20090124602-A1 KINASE INHIBITORS MAP3K20, MAP3K1, MAP3K6 CKS1B 137/4885SKP1 386/4885SKP2 219/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.