SCHEMBL7475898

SCHEMBL7475898

CCN(CC)C(=O)Nc1ccc(S(=O)(=O)N2C(=O)C(NC)(c3ccccc3Cl)c3cc(C(F)(F)F)ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 4/20 0.38
MAPT P10636 4/20 0.37
NPSR1 Q6W5P4 2/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 2/20 0.36
AVPR2 P30518 1/20 0.36
GPR27 Q9NS67 1/20 0.36
KCNJ5 P48544 1/20 0.36
KCNJ3 P48549 1/20 0.36
GNRHR P30968 1/20 0.35
NAMPT P43490 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 2/20 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 0.84 NPSR1 (0.45) MAPTNPSR1HTTGAAGPR27
SCHEMBL7471625 0.81 NPSR1 (0.41) MAPTNPSR1HTTGAANAMPT
SCHEMBL7471873 0.79 KMT2A (0.42) MAPTNPSR1HTTSMN1; SMN2GAA
SCHEMBL7461629 0.79 NPSR1 (0.43) MAPTNPSR1HTTGAAGPR27
SCHEMBL7475739 0.79 NPSR1 (0.38) MAPTNPSR1HTTGAANAMPT
Trifluoroacetic Acid SCHEMBL8592809 0.79 NPSR1 (0.36) MAPTNPSR1GAACA12CA1
SCHEMBL8593348 0.79 NPSR1 (0.39) MAPTNPSR1GAAAVPR2NAMPT
SCHEMBL7471149 0.79 NPSR1 (0.39) MAPTNPSR1HTTGAAAVPR2
SCHEMBL7477246 0.79 NPSR1 (0.39) MAPTNPSR1HTTGAAAVPR2
SCHEMBL8742735 0.79 NPSR1 (0.40) MAPTNPSR1GAAGPR27NAMPT

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