SCHEMBL27059971

SCHEMBL27059971

CCC(C)(C)OC(=O)N1CCC(n2cc(Nc3ncc(C)c(-c4ccc(C(=O)NCC#N)cc4)n3)cn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 13/20 0.57
▸ JAK3 P52333 13/20 0.57
▸ JAK1 P23458 10/20 0.57
▸ IGF1R P08069 7/20 0.42
▸ PTK2 Q05397 1/20 0.42

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
SCHEMBL29942607 0.94 JAK2 (0.59) JAK2JAK3JAK1IGF1RPTK2
SCHEMBL24852608 0.94 JAK2 (0.59) JAK2JAK3JAK1IGF1RPTK2
SCHEMBL29941565 0.89 JAK2 (0.61) JAK2JAK3JAK1IGF1R
SCHEMBL22089941 0.89 JAK2 (0.61) JAK2JAK3JAK1IGF1R
SCHEMBL22097753 0.88 JAK2 (0.60) JAK2JAK3JAK1IGF1R
SCHEMBL29942053 0.88 JAK2 (0.60) JAK2JAK3JAK1IGF1R
SCHEMBL22097984 0.88 JAK2 (0.63) JAK2JAK3JAK1IGF1R
SCHEMBL24852781 0.87 JAK2 (0.59) JAK2JAK3JAK1IGF1R
SCHEMBL29941598 0.87 JAK2 (0.59) JAK2JAK3JAK1IGF1R
SCHEMBL22097815 0.87 JAK2 (0.62) JAK2JAK3JAK1IGF1R

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 JAK2 1/4885JAK3 3/4885JAK1 2/4885

“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.

Send feedback