SCHEMBL3069060

SCHEMBL3069060

Cc1cc(Oc2ccc3c(c2)cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n3C)ncc1NC(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 13/20 0.46
SCN9A Q15858 3/20 0.45
LIPE Q05469 3/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
XBP1 P17861 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL3055575 0.89 HRH3 (0.41) STAT3SCN9A
SCHEMBL3051577 0.89 SCN9A (0.48) STAT3SCN9ALIPE
SCHEMBL3063504 0.88 SCN9A (0.43) STAT3SCN9ALIPEMAPT
SCHEMBL3059483 0.88 RAB9A (0.49) STAT3SCN9AGAAMAPTSMN1; SMN2
SCHEMBL3057440 0.86 STAT3 (0.44) STAT3SCN9ALMNAGAAMAPT
Bromide SCHEMBL3051472 0.86 STAT3 (0.55) STAT3
SCHEMBL3046701 0.85 STAT3 (0.44) STAT3SCN9AMAPTSMN1; SMN2
SCHEMBL3052640 0.84 SCN9A (0.54) STAT3SCN9A
Oxalic Acid SCHEMBL3068989 0.84 STAT3 (0.59) STAT3
Bromide SCHEMBL3062650 0.83 STAT3 (0.52) STAT3

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-8551999-B2 Heterocyclic compound and pharmaceutical composition thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-10-08 US disclosed
EP-2207773-B1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMA CO LTD (JP) 2012-07-11 EP disclosed
US-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-10-14 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-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF COL1A1, COL2A1, COL14A1 STAT3 1499/4885SCN9A 2616/4885LIPE 4198/4885

“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.