SCHEMBL27065507

SCHEMBL27065507

COC(=O)c1ccc(-c2nc(Nc3cnn(C4CCCN(C)C4)c3)ncc2C)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MELK Q14680 2/20 0.44
▸ IGF1R P08069 2/20 0.43
▸ FLT4 P35916 2/20 0.42
▸ KDR P35968 1/20 0.42
▸ JAK2 O60674 5/20 0.42
▸ JAK3 P52333 4/20 0.42
▸ JAK1 P23458 3/20 0.42
▸ TYK2 P29597 1/20 0.41
▸ CDK4 P11802 1/20 0.41
▸ CCND1 P24385 1/20 0.41
▸ CCNE1 P24864 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCND3 P30281 1/20 0.41
▸ CDK6 Q00534 1/20 0.41
▸ MERTK Q12866 1/20 0.40

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
SCHEMBL24853210 0.90 IGF1R (0.51) IGF1RFLT4KDRJAK2JAK3
SCHEMBL24852545 0.90 MERTK (0.47) IGF1RJAK2JAK3JAK1TYK2
SCHEMBL24852530 0.89 IGF1R (0.46) IGF1RJAK2JAK3JAK1TYK2
SCHEMBL24853547 0.87 JAK3 (0.44) IGF1RKDRJAK2JAK3JAK1
SCHEMBL22097792 0.86 JAK2 (0.60) KDRJAK2JAK3JAK1TYK2
SCHEMBL27059432 0.85 KDR (0.49) IGF1RFLT4KDRJAK2JAK3
SCHEMBL24852534 0.85 IGF1R (0.52) IGF1RFLT4JAK2JAK3JAK1
SCHEMBL24852470 0.85 JAK2 (0.45) IGF1RJAK2JAK3JAK1TYK2
SCHEMBL27065506 0.85 JAK2 (0.39) IGF1RKDRJAK2JAK3JAK1
SCHEMBL27059430 0.85 IGF1R (0.42) IGF1RFLT4JAK2JAK3JAK1

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
US-20240025882-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-01-25 — — 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 (1 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-20240025882-A1 BENZAMIDES OF PYRAZOLYLAMINO- PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF JAK2, JAK1, JAK3 MELK 450/4885IGF1R 2899/4885FLT4 1247/4885

“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.

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