SCHEMBL1875220

SCHEMBL1875220

CCOc1ncccc1C1(N)C(=O)N(S(=O)(=O)c2ccc(OC)cc2)c2ccc(C#N)cc21

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 18/20 0.58
CYP3A4 P08684 2/20 0.48
GPR6 P46095 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL17261046 1.00 AVPR1B (0.58) AVPR1BCYP3A4GPR6MEN1MAPT
SCHEMBL1786609 0.89 AVPR1B (0.73) AVPR1BCYP3A4
SCHEMBL17261132 0.86 AVPR1B (0.45) AVPR1BCYP3A4MEN1MAPTKMT2A
SCHEMBL1589927 0.86 AVPR1B (0.45) AVPR1BCYP3A4MEN1MAPTKMT2A
SCHEMBL17261059 0.85 AVPR1B (0.53) AVPR1BCYP3A4GPR6
SCHEMBL17261101 0.84 AVPR1B (0.53) AVPR1BCYP3A4GPR6
SCHEMBL16837244 0.83 AVPR1B (0.58) AVPR1BCYP3A4GPR6
SCHEMBL1878467 0.82 AVPR1B (0.51) AVPR1BCYP3A4GPR6
SCHEMBL6521385 0.82 AVPR1B (0.52) AVPR1BCYP3A4GPR6
SCHEMBL3227218 0.80 AVPR1B (0.51) AVPR1BCYP3A4GPR6KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3143023-B1 OXINDOLE COMPOUNDS CARRYING A CO-BOUND SPIRO SUBSTITUENT AND USE THEREOF FOR TREATING VASOPRESSIN-RELATED DISEASES ABBVIE DEUTSCHLAND (DE) 2018-04-11 EP disclosed
US-9527856-B2 Oxindole compounds carrying a CO-bound spiro substituent and use thereof for treating vasopressin-related diseases AbbVie Deutschland GmbH & Co. KG (DE) 2016-12-27 US disclosed
EP-2227463-B1 SUBSTITUTED OXINDOLE-DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES ABBVIE DEUTSCHLAND (DE) 2016-08-17 EP disclosed
US-9238642-B2 Substituted oxindole-derivatives and the use thereof for the treatment of vasopressin-dependent illnesses AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-19 US disclosed
US-20150344489-A1 OXINDOLE COMPOUNDS CARRYING A CO-BOUND SPIRO SUBSTITUENT AND USE THEREOF FOR TREATING VASOPRESSIN-RELATED DISEASES AbbVie Deutschland GmbH & Co. KG (DE) 2015-12-03 US disclosed
US-20140303138-A1 SUBSTITUTED OXINDOLE-DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES AbbVie Deutschland GmbH & Co. KG (DE) 2014-10-09 US disclosed
US-8629148-B2 Substituted oxindole-derivatives and the use thereof for the treatment of vasopressin-dependent illnesses AbbVie Deutschland GmbH & Co. KG (DE) 2014-01-14 US disclosed
US-20110105454-A1 SUBSTITUTED OXINDOLE-DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES ABBOTT GMBH & CO. KG (DE) 2011-05-05 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 (3 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-20140303138-A1 SUBSTITUTED OXINDOLE-DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES AVPR2, AVPR1B, AVPR1A AVPR1B 2/4885CYP3A4 1566/4885GPR6 1144/4885
US-20150344489-A1 OXINDOLE COMPOUNDS CARRYING A CO-BOUND SPIRO SUBSTITUENT AND USE THEREOF FOR TREATING VASOPRESSIN-RELATED DISEASES AVPR2, AVPR1B, AVPR1A AVPR1B 2/4885CYP3A4 1412/4885GPR6 712/4885
US-20110105454-A1 SUBSTITUTED OXINDOLE-DERIVATIVES AND THE USE THEREOF FOR THE TREATMENT OF VASOPRESSIN-DEPENDENT ILLNESSES AVPR2, AVPR1B, AVPR1A AVPR1B 2/4885CYP3A4 1566/4885GPR6 1144/4885

“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.