SCHEMBL16776092

SCHEMBL16776092

Cn1cc(-c2ccc3c(n2)N(C(=O)Nc2ccccn2)CCCN3)cn1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 1/20 0.44
▸ CSF1R P07333 15/20 0.41
▸ KIT P10721 6/20 0.41
▸ PDGFRA P16234 4/20 0.41
▸ PDGFRB P09619 3/20 0.41
▸ WNT1 P04628 1/20 0.40
▸ GSK3B P49841 1/20 0.40
▸ DYRK1A Q13627 1/20 0.40
▸ MET P08581 2/20 0.39
▸ KDR P35968 1/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ RPS6KA3 P51812 1/20 0.38
▸ RPS6KA2 Q15349 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.38

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
SCHEMBL16776080 0.85 FGFR4 (0.46) FGFR4RPS6KA3RPS6KA2
SCHEMBL16776073 0.85 FGFR4 (0.44) FGFR4WNT1GSK3BDYRK1ARPS6KA3
SCHEMBL16776095 0.84 FGFR4 (0.43) FGFR4DYRK1ARPS6KA3RPS6KA2
SCHEMBL16776087 0.84 EGFR (0.43) FGFR4KDRRPS6KA3RPS6KA2
SCHEMBL16776131 0.84 MCL1 (0.45) RPS6KA3
SCHEMBL16776013 0.84 FGFR4 (0.44) FGFR4RPS6KA3RPS6KA2
SCHEMBL16776175 0.83 FGFR4 (0.46) FGFR4WNT1GSK3BDYRK1ARPS6KA3
SCHEMBL16776075 0.83 FGFR4 (0.46) FGFR4RPS6KA3RPS6KA2
SCHEMBL16776089 0.83 FGFR4 (0.46) FGFR4RPS6KA3RPS6KA2
SCHEMBL16776064 0.83 ATR (0.47) FGFR4RPS6KA3RPS6KA2

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-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2015-06-04 — — US disclosed
US-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2015-06-04 — — 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-20150152108-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 FGFR4 1754/4885CSF1R 2306/4885KIT 2844/4885

“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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