SCHEMBL10321069

SCHEMBL10321069

N#Cc1ccc(C(=O)N2[C@@H]3CC[C@@H]2CN(c2ncnc4[nH]ccc24)C3)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 17/20 0.56
JAK3 P52333 12/20 0.56
JAK1 P23458 8/20 0.53
TYK2 P29597 5/20 0.53
BTK Q06187 1/20 0.47

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
SCHEMBL1047885 1.00 JAK2 (0.56) JAK2JAK3JAK1TYK2BTK
SCHEMBL10316940 0.85 JAK3 (0.61) JAK2JAK3JAK1TYK2
SCHEMBL1048943 0.85 JAK3 (0.61) JAK2JAK3JAK1TYK2
SCHEMBL10318081 0.84 JAK3 (0.63) JAK2JAK3JAK1TYK2BTK
SCHEMBL1050276 0.84 JAK3 (0.63) JAK2JAK3JAK1TYK2BTK
SCHEMBL1077571 0.82 JAK2 (0.52) JAK2JAK3JAK1TYK2BTK
SCHEMBL10321408 0.82 JAK2 (0.56) JAK2JAK3JAK1TYK2
SCHEMBL1050643 0.82 JAK2 (0.56) JAK2JAK3JAK1TYK2
SCHEMBL10320147 0.81 JAK3 (0.51) JAK2JAK3JAK1TYK2
SCHEMBL1049399 0.81 JAK3 (0.51) JAK2JAK3JAK1TYK2

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
US-9346809-B2 Heterocyclic compounds as JAK receptor and protein tyrosine kinase inhibitors LEO PHARMA A/S (DK) 2016-05-24 US disclosed
US-20120178740-A1 HETEROCYCLIC COMPOUNDS AS JAK RECEPTOR AND PROTEIN TYROSINE KINASE INHIBITORS LEO PHARMA A/S (DK) 2012-07-12 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-20120178740-A1 HETEROCYCLIC COMPOUNDS AS JAK RECEPTOR AND PROTEIN TYROSINE KINASE INHIBITORS JAK1, JAK2, JAK3 JAK2 2/4885JAK3 3/4885JAK1 1/4885

“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.