SCHEMBL3060639

SCHEMBL3060639

C[C@H]1CN(C(=O)c2cc3ccc(Oc4ccc(N(C)C(=O)c5ccc(OF)cc5)cn4)cc3n2C)CCN1Cc1ccc(OC(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 18/20 0.41
MLNR O43193 2/20 0.40

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
SCHEMBL10180491 0.94 STAT3 (0.47) STAT3MLNR
SCHEMBL10180492 0.94 STAT3 (0.47) STAT3MLNR
Bromide SCHEMBL3059647 0.86 STAT3 (0.52) STAT3
SCHEMBL3045913 0.86 STAT3 (0.56) STAT3
SCHEMBL3045917 0.86 STAT3 (0.56) STAT3
SCHEMBL3065118 0.85 STAT3 (0.55) STAT3
SCHEMBL10181171 0.85 STAT3 (0.51) STAT3
SCHEMBL10180672 0.84 STAT3 (0.57) STAT3
Hydrochloric Acid SCHEMBL3051249 0.84 STAT3 (0.50) STAT3
Bromide SCHEMBL3056336 0.84 STAT3 (0.56) 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 2 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
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 1499/4885MLNR 3041/4885

“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.