SCHEMBL7473969

SCHEMBL7473969

COc1cc(C(=O)O)ccc1S(=O)(=O)N1C(=O)C(N)(c2ccccc2Cl)c2cc(Cl)ccc21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 18/20 0.46
AVPR1A P37288 5/20 0.46
OXTR P30559 4/20 0.46
AVPR2 P30518 2/20 0.46
GPR65 Q8IYL9 1/20 0.46
TTR P02766 1/20 0.40
TP53 P04637 1/20 0.39
MDM2 Q00987 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
SCHEMBL7465671 0.89 AVPR1B (0.43) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL8592735 0.89 AVPR1B (0.42) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL5677707 0.87 AVPR1B (0.57) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7462034 0.87 AVPR1B (0.48) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7475235 0.86 AVPR1B (0.45) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7472316 0.85 AVPR1B (0.46) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7459741 0.84 POLB (0.46) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7471223 0.83 AVPR1B (0.45) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL8591812 0.82 AVPR1B (0.43) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7468172 0.81 AVPR1B (0.43) 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
EP-0687251-B1 1,3-DIHYDROINDOL-2-ONE DERIVATIVES SUBSTITUTED IN POSITION 3 BY A NITROGEN GROUP AS VASOPRESSIN AND/OR OCYTOCINE AGONISTS AND/OR ANTAGONISTS SANOFI SYNTHELABO (FR) 2002-02-27 EP disclosed
US-5594023-A 1,3-dihydroindol-2-one derivatives substituted in the 3-position by a nitrogen-containing group, their preparation and the pharmaceutical compositions in which they are present SANOFI (FR) 1997-01-14 US disclosed
EP-0687251-A1 1,3-DIHYDROINDOL-2-ONE DERIVATIVES SUBSTITUTED IN POSITION 3 BY A NITROGEN GROUP AS VASOPRESSIN AND/OR OCYTOCINE AGONISTS AND/OR ANTAGONISTS SANOFI (FR) 1995-12-20 EP disclosed
WO-1995018105-A1 1,3-DIHYDROINDOL-2-ONE DERIVATIVES SUBSTITUTED IN POSITION 3 BY A NITROGEN GROUP AS VASOPRESSIN AND/OR OCYTOCINE AGONISTS AND/OR ANTAGONISTS SANOFI (FR) 1995-07-06 WO disclosed