SCHEMBL3067846

SCHEMBL3067846

CNc1cnc(Oc2ccc3cc(C(=O)N4CCN(Cc5ccc(OC(C)C)cc5)CC4)n(C)c3c2)nc1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 18/20 0.49
FAAH O00519 1/20 0.45
LTA4H P09960 1/20 0.45

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
Hydrochloric Acid SCHEMBL3067677 0.86 STAT3 (0.59) STAT3
SCHEMBL3052247 0.86 STAT3 (0.46) STAT3LTA4H
SCHEMBL3062164 0.85 STAT3 (0.55) STAT3
SCHEMBL10192345 0.83 STAT3 (0.57) STAT3
Hydrochloric Acid SCHEMBL10192353 0.82 STAT3 (0.56) STAT3
SCHEMBL3057007 0.82 STAT3 (0.48) STAT3LTA4H
Hydrochloric Acid SCHEMBL3061018 0.81 STAT3 (0.58) STAT3
SCHEMBL3046029 0.81 STAT3 (0.43) STAT3LTA4H
SCHEMBL10180922 0.81 STAT3 (0.56) STAT3
Hydrochloric Acid SCHEMBL3057184 0.80 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 1499/4885FAAH 2709/4885LTA4H 1802/4885

“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.