SCHEMBL13965756

SCHEMBL13965756

CC(C)(C)CCCCCn1ccc(N)nc1=O

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 12/20 0.41
▸ FGFR1 P11362 3/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ DNMT1 P26358 1/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ SLC22A6 Q4U2R8 1/20 0.36
▸ DRD2 P14416 2/20 0.35
▸ DRD3 P35462 2/20 0.35

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
SCHEMBL4245808 0.83 FGFR1 (0.48) EP300FGFR1
SCHEMBL27723178 0.83 FGFR1 (0.48) EP300FGFR1
SCHEMBL13975422 0.83 FGFR1 (0.48) EP300FGFR1
SCHEMBL25628523 0.83 FGFR1 (0.48) EP300FGFR1
SCHEMBL27977634 0.83 FGFR1 (0.48) EP300FGFR1
SCHEMBL23343373 0.82 FGFR1 (0.44) EP300FGFR1CYP2D6DNMT1HDAC1
SCHEMBL13261399 0.81 TLR8 (0.47) EP300FGFR1
SCHEMBL6551980 0.80 FGFR1 (0.45) EP300FGFR1CYP2D6DNMT1HDAC1
SCHEMBL19631097 0.80 FGFR1 (0.45) EP300FGFR1SLC22A6
SCHEMBL8840764 0.80 FGFR1 (0.41) EP300FGFR1CYP2D6DNMT1HDAC1

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-20120295903-A1 FLAVIN DERIVATIVES BLOUNT KENNETH F (US) 2012-11-22 — — 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-20120295903-A1 FLAVIN DERIVATIVES BLVRB, FLAD1, FDPS EP300 3376/4885FGFR1 1245/4885CYP2D6 229/4885

“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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