SCHEMBL13756697

SCHEMBL13756697

CS(=O)(=O)c1ccc(N2CCc3cnc(Nc4ccc(F)c(C(=O)N5CCOCC5)c4)nc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 1/20 0.41
▸ CDK4 P11802 1/20 0.41
▸ CDK6 Q00534 1/20 0.41
▸ STAT6 P42226 6/20 0.41
▸ JAK2 O60674 4/20 0.41
▸ LRRK2 Q5S007 4/20 0.41
▸ EPHX2 P34913 1/20 0.40
▸ BRD4 O60885 1/20 0.40
▸ ALK Q9UM73 2/20 0.39
▸ NTRK1 P04629 2/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK2 P24941 1/20 0.39

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
SCHEMBL13756842 0.90 NUAK1 (0.45) CSF1RCDK4CDK6STAT6JAK2
SCHEMBL13756768 0.86 NUAK1 (0.44) CDK4JAK2EPHX2BRD4CCNA2
SCHEMBL13756766 0.86 NTRK1 (0.49) JAK2LRRK2NTRK1CCNA2CDK2
SCHEMBL13756843 0.82 NUAK1 (0.47) CSF1RJAK2BRD4CCNA2CDK2
SCHEMBL1654907 0.82 RPS6KA3 (0.56) CDK4JAK2BRD4
SCHEMBL13756769 0.82 NUAK1 (0.54) CSF1RCDK4JAK2BRD4CCNA2
SCHEMBL13756696 0.80 CSF1R (0.46) CSF1RCDK4CDK6STAT6JAK2
SCHEMBL13756800 0.80 CDK2 (0.46) CDK4JAK2BRD4CDK2
SCHEMBL13756756 0.79 PTGS2 (0.48) CDK4STAT6JAK2BRD4CDK2
SCHEMBL13756839 0.78 JAK2 (0.55) CDK4CDK6STAT6JAK2LRRK2

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-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 CSF1R 1606/4885CDK4 186/4885CDK6 121/4885

“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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