SCHEMBL1589927

SCHEMBL1589927

CCOc1ncccc1C1(N)C(=O)N(S(=O)(=O)c2ccc(OC)cc2)c2cc(F)c(C#N)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 16/20 0.45
CYP3A4 P08684 2/20 0.37
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
STAT3 P40763 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34
TUBB4B P68371 1/20 0.34
TUBB3 Q13509 1/20 0.34
TUBB2A Q13885 1/20 0.34
TUBB8 Q3ZCM7 1/20 0.34
TUBA3E Q6PEY2 1/20 0.34
TUBA1A Q71U36 1/20 0.34
TUBA1C Q9BQE3 1/20 0.34
TUBB6 Q9BUF5 1/20 0.34
TUBB2B Q9BVA1 1/20 0.34

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
SCHEMBL17261132 1.00 AVPR1B (0.45) AVPR1BCYP3A4MEN1MAPTKMT2A
SCHEMBL1589499 0.89 AVPR1B (0.57) AVPR1B
SCHEMBL17261046 0.86 AVPR1B (0.58) AVPR1BCYP3A4MEN1MAPTKMT2A
SCHEMBL1875220 0.86 AVPR1B (0.58) AVPR1BCYP3A4MEN1MAPTKMT2A
SCHEMBL15279956 0.85 AVPR1B (0.41) AVPR1BCYP3A4SLC22A12
SCHEMBL1589612 0.83 AVPR1B (0.39) AVPR1BCYP3A4KMT2A
SCHEMBL1876402 0.81 AVPR1B (0.48) AVPR1BCYP3A4MAPT
SCHEMBL1880680 0.81 AVPR1B (0.46) AVPR1BCYP3A4MAPTKMT2A
SCHEMBL1871648 0.80 AVPR1B (0.45) AVPR1BCYP3A4MAPT
SCHEMBL1589255 0.80 KMT2A (0.40) AVPR1BMEN1MAPTKMT2A

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 13 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
EP-3143023-A1 OXINDOLE COMPOUNDS CARRYING A CO-BOUND SPIRO SUBSTITUENT AND USE THEREOF FOR TREATING VASOPRESSIN-RELATED DISEASES AbbVie Deutschland GmbH & Co. KG (DE) 2017-03-22 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
US-9434713-B2 5,6-disubstituted oxindole-derivatives and use thereof for treating vasopressin-dependent diseases AbbVie Deutschland GmbH & Co. KG (DE) 2016-09-06 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
WO-2015173392-A1 OXINDOLE COMPOUNDS CARRYING A CO-BOUND SPIRO SUBSTITUENT AND USE THEREOF FOR TREATING VASOPRESSIN-RELATED DISEASES AbbVie Deutschland GmbH & Co. KG (DE) 2015-11-19 WO disclosed
US-20140194440-A1 5,6-DISUBSTITUTED OXINDOLE-DERIVATIVES AND USE THEREOF FOR TREATING VASOPRESSIN-DEPENDENT DISEASES AbbVie Deutschland GmbH & Co. KG (DE) 2014-07-10 US disclosed
EP-2231644-B1 5,6-Disubstituted oxindole derivatives and their use in the manufacture of a medicament for the treatment of vasopressin-dependent diseases ABBVIE DEUTSCHLAND (DE) 2014-01-15 EP disclosed
US-8546401-B2 5,6-disubstituted oxindole-derivatives and use thereof for treating vasopressin-dependent diseases AbbVie Deutschland GmbH & Co. KG (DE) 2013-10-01 US disclosed
EP-2623504-A1 5,6-Disubstituted oxindole derivatives and their use in the manufacture of a medicament for the treatment of vasopressin-dependent diseases Abbott GmbH & Co. KG (DE) 2013-08-07 EP disclosed
US-20110092513-A1 5,6-DISUBSTITUTED OXINDOLE-DERIVATIVES AND USE THEREOF FOR TREATING VASOPRESSIN-DEPENDENT DISEASES ABBOTT GMBH & CO. KG 2011-04-21 US disclosed
EP-2231644-A2 5,6-DISUBSTITUTED OXINDOLE-DERIVATIVES AND USE THEREOF FOR TREATING VASOPRESSINE-DEPENDENT DISEASES Abbott GmbH & Co. KG (DE) 2010-09-29 EP disclosed
WO-2009071690-A2 5,6-DISUBSTITUTED OXINDOLE-DERIVATIVES AND USE THEREOF FOR TREATING VASOPRESSINE-DEPENDENT DISEASES ABBOTT GMBH & CO. KG (DE) 2009-06-11 WO 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-20110092513-A1 5,6-DISUBSTITUTED OXINDOLE-DERIVATIVES AND USE THEREOF FOR TREATING VASOPRESSIN-DEPENDENT DISEASES AVPR2, AVPR1B, AVPR1A AVPR1B 2/4885CYP3A4 3678/4885MEN1 804/4885
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 1412/4885MEN1 468/4885
US-20140194440-A1 5,6-DISUBSTITUTED OXINDOLE-DERIVATIVES AND USE THEREOF FOR TREATING VASOPRESSIN-DEPENDENT DISEASES AVPR2, AVPR1B, AVPR1A AVPR1B 2/4885CYP3A4 3678/4885MEN1 804/4885

“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.