SCHEMBL7468569

SCHEMBL7468569

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
NOD2 Q9HC29 1/20 0.35
NOD1 Q9Y239 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 6/20 0.34
MAPT P10636 3/20 0.34
FAAH O00519 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 3/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 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
SCHEMBL7466648 0.89 NPSR1 (0.45) NPSR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7466135 0.84 PARL (0.38) FLT1FLT4KDRALDH1A1MEN1
SCHEMBL7475734 0.84 NPSR1 (0.37) NPSR1ALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7470096 0.83 FAAH (0.41) FLT1FLT4KDRNPC1RAB9A
SCHEMBL7461629 0.82 NPSR1 (0.43) NPSR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7473127 0.81 NPSR1 (0.40) NPSR1ALDH1A1MAPTMEN1KMT2A
Water SCHEMBL8742815 0.81 NPSR1 (0.39) NPSR1ALDH1A1MAPTMEN1KMT2A
Water SCHEMBL8742816 0.81 NPSR1 (0.39) NPSR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7472220 0.80 NPSR1 (0.40) NPSR1ALDH1A1MAPTMEN1KMT2A
SCHEMBL7471625 0.79 NPSR1 (0.41) NPSR1ALDH1A1MAPTMEN1KMT2A

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