SCHEMBL7470397

SCHEMBL7470397

CCOC(=O)NC1(c2ccccc2Cl)C(=O)N(S(=O)(=O)c2ccc(NC(=O)N3CCOCC3)cc2OC)c2ccc(Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
AVPR1B P47901 8/20 0.39
AVPR1A P37288 3/20 0.39
OXTR P30559 2/20 0.39
AVPR2 P30518 1/20 0.39
GPR65 Q8IYL9 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.37
RAB9A P51151 1/20 0.37
ROS1 P08922 1/20 0.37
ALK Q9UM73 1/20 0.37
HTT P42858 1/20 0.37
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36

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
SCHEMBL7467483 0.86 POLB (0.42) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7471248 0.83 AVPR1B (0.42) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7471418 0.81 AVPR1B (0.43) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7466089 0.81 AVPR1B (0.40) SMN1; SMN2AVPR1BAVPR1AOXTRAVPR2
SCHEMBL7471933 0.81 AVPR1B (0.42) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7469886 0.80 POLB (0.46) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL8742777 0.79 POLB (0.45) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7469533 0.79 AVPR1B (0.43) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7462148 0.78 AVPR1B (0.43) AVPR1BAVPR1AOXTRAVPR2GPR65
SCHEMBL7470715 0.77 POLB (0.44) 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-5773612-A VASOPRESSIN OR OXYTOCIN RECEPTORS SANOFI (FR) 1998-06-30 US 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
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