SCHEMBL7470096

SCHEMBL7470096

O=C(NC1(c2ccccc2Cl)C(=O)N(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(Cl)cc21)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.41
MGLL Q99685 2/20 0.39
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
AVPR1B P47901 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
CTSG P08311 1/20 0.34
CMA1 P23946 1/20 0.34
PTPN7 P35236 1/20 0.34
PTPN12 Q05209 1/20 0.34
PTPN22 Q9Y2R2 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
SCHEMBL7466135 0.83 PARL (0.38) FLT1FLT4KDRAVPR1BALDH1A1
SCHEMBL7468569 0.83 FLT1 (0.35) FAAHMGLLFLT1FLT4KDR
SCHEMBL7472220 0.82 NPSR1 (0.40) AVPR1BALDH1A1MAPTTHRB
SCHEMBL7474922 0.80 AVPR1B (0.43) AVPR1BALDH1A1MAPT
SCHEMBL7466241 0.79 NPSR1 (0.39) FAAHAVPR1BALDH1A1MAPTTHRB
SCHEMBL5674427 0.79 AVPR1B (0.51) AVPR1B
SCHEMBL7469886 0.77 POLB (0.46) FAAHAVPR1BMAPT
SCHEMBL7466089 0.77 AVPR1B (0.40) AVPR1BALDH1A1MAPT
SCHEMBL7471384 0.77 AVPR1B (0.44) AVPR1BALDH1A1MAPT
SCHEMBL7478155 0.77 PARL (0.40) FAAHMGLLFLT1FLT4KDR

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