SCHEMBL4285212

SCHEMBL4285212

Cc1ccc(Nc2ncc3ccn(-c4cc(F)c(CN5CCS(O)(O)CC5)c(F)c4)c3n2)cc1CN1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 17/20 0.44
BRD4 O60885 17/20 0.44
JAK1 P23458 5/20 0.44
BRD2 P25440 5/20 0.44
JAK3 P52333 5/20 0.44
BRD3 Q15059 5/20 0.44
BRDT Q58F21 5/20 0.44
RPS6KA3 P51812 2/20 0.43
STAT6 P42226 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
SCHEMBL27824869 0.94 JAK2 (0.48) JAK2BRD4JAK1BRD2JAK3
SCHEMBL4285194 0.93 JAK2 (0.46) JAK2BRD4JAK1BRD2JAK3
SCHEMBL1655276 0.92 RPS6KA3 (0.49) JAK2BRD4JAK1BRD2JAK3
SCHEMBL1657636 0.90 JAK2 (0.42) JAK2BRD4JAK1BRD2JAK3
SCHEMBL27824885 0.90 JAK2 (0.45) JAK2BRD4JAK1BRD2JAK3
SCHEMBL1654764 0.89 RPS6KA3 (0.48) JAK2BRD4JAK1BRD2JAK3
SCHEMBL1657504 0.89 RPS6KA3 (0.47) JAK2BRD4JAK1BRD2JAK3
SCHEMBL1654955 0.88 JAK2 (0.44) JAK2BRD4JAK1BRD2JAK3
SCHEMBL4286088 0.88 AXL (0.47) JAK2BRD4JAK1BRD2JAK3
SCHEMBL4288934 0.88 RPS6KA3 (0.47) JAK2BRD4JAK1BRD2JAK3

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
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US claimed
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 JAK2 2/4885BRD4 964/4885JAK1 3/4885

“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.