SCHEMBL1798253

SCHEMBL1798253

COc1ccc(S(=O)(=O)N2C(=O)C(OC(=O)N3CCN(C4CCN(C)CC4)CC3)(c3ccccc3OC)c3cc(F)ccc32)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 18/20 0.43
AVPR1A P37288 6/20 0.43
OXTR P30559 5/20 0.43
AVPR2 P30518 2/20 0.43
GPR65 Q8IYL9 1/20 0.43
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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 SCHEMBL1797751 0.95 AVPR1B (0.45) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL1796024 0.95 AVPR1B (0.45) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1795598 0.93 AVPR1B (0.44) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1796758 0.92 AVPR1B (0.43) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1799738 0.92 AVPR1B (0.45) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL27681627 0.92 AVPR1B (0.40) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1795096 0.92 AVPR1B (0.52) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1799426 0.90 AVPR1B (0.42) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1796945 0.90 DRD2 (0.41) AVPR1BAVPR1AOXTRAVPR2GPR65
Hydrochloric Acid SCHEMBL1794296 0.90 AVPR1B (0.46) AVPR1BAVPR1AOXTRAVPR2GPR65

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338590-B2 Substituted oxindole derivatives and medicaments containing the same ABBOTT GMBH & CO. KG (DE) 2012-12-25 US disclosed
US-20110257194-A1 SUBSTITUTED OXINDOL DERIVATIVES AND MEDICAMENTS CONTAINING THE SAME ABBOTT GMBH & CO. KG (DE) 2011-10-20 US disclosed
US-7951807-B2 Substituted oxindol derivatives and medicaments containing the same ABBOTT GMBH & CO. KG (DE) 2011-05-31 US disclosed
US-20090005397-A1 Substituted Oxindol Derivatives and Medicaments Containing the Same ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2009-01-01 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 (2 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-20090005397-A1 Substituted Oxindol Derivatives and Medicaments Containing the Same OXTR, AVPR2, AVPR1B AVPR1B 3/4885AVPR1A 4/4885OXTR 1/4885
US-20110257194-A1 SUBSTITUTED OXINDOL DERIVATIVES AND MEDICAMENTS CONTAINING THE SAME OXTR, AVPR2, AVPR1B AVPR1B 3/4885AVPR1A 4/4885OXTR 1/4885

“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.