SCHEMBL7476931

SCHEMBL7476931

CCN(CC)CCC(=O)NC1(c2ccccc2Cl)C(=O)N(S(=O)(=O)c2ccc(NC(=O)N(CC)CC)cc2)c2cc(C)c(Cl)cc21

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 1/20 0.36
TERT O14746 3/20 0.33
NR1I3 Q14994 1/20 0.33
HTR6 P50406 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
NAMPT P43490 1/20 0.32
ATM Q13315 1/20 0.32
GPR27 Q9NS67 2/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP2D6 P10635 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL7472764 0.87 NPSR1 (0.36) NPSR1GAATERTNR1I3HTR6
SCHEMBL7466648 0.81 NPSR1 (0.45) NPSR1GAANR1I3MAPTLMNA
SCHEMBL234713 0.79 MAPT (0.32) NPSR1GAAMAPTNAMPT
SCHEMBL7461629 0.78 NPSR1 (0.43) NPSR1GAAMAPTLMNANAMPT
SCHEMBL7471873 0.77 KMT2A (0.42) NPSR1GAAMAPTLMNAKDM4E
SCHEMBL7470255 0.77 NPSR1 (0.35) NPSR1GAANR1I3MAPTLMNA
SCHEMBL7472220 0.76 NPSR1 (0.40) NPSR1GAAMAPTLMNA
SCHEMBL7473127 0.75 NPSR1 (0.40) NPSR1GAANR1I3MAPTLMNA
SCHEMBL7475898 0.75 TRPV4 (0.38) NPSR1GAAMAPTLMNANAMPT
SCHEMBL7471625 0.75 NPSR1 (0.41) NPSR1GAANR1I3MAPTLMNA

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 5 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
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