SCHEMBL7470476

SCHEMBL7470476

Cc1c(Cl)ccc2c1C(c1ccccc1Cl)C(=O)N2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.42
TP53 P04637 3/20 0.41
MAPT P10636 2/20 0.41
ALOX15 P16050 2/20 0.41
CYP2C9 P11712 2/20 0.41
RECQL P46063 2/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
CYP2C19 P33261 1/20 0.41
SLC8B1 Q6J4K2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
CACNB4 O00305 1/20 0.39
CACNA1A O00555 1/20 0.39
CACNA1G O43497 1/20 0.39
CACNG3 O60359 1/20 0.39
CACNA1F O60840 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNB3 P54284 1/20 0.39
CACNA2D1 P54289 1/20 0.39

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
SCHEMBL4590172 0.85 HTR2C (0.41) GSK3BTP53MAPTALOX15CYP2C9
SCHEMBL4590075 0.82 HTR1A (0.48) GSK3BTP53MAPTALOX15CYP2C9
SCHEMBL5678203 0.77 MAPT (0.44) TP53MAPTALOX15CYP2C9RECQL
SCHEMBL7852811 0.76 IDO1 (0.49) GSK3BTP53MAPTALOX15CYP2C9
SCHEMBL4589629 0.75 SMN1; SMN2 (0.40) TP53MAPTALOX15CYP2C9RECQL
SCHEMBL5674294 0.73 BRD4 (0.41) TP53MAPTALOX15CYP2C9RECQL
SCHEMBL7469707 0.73 BRD4 (0.41) TP53MAPTALOX15CYP2C9RECQL
SCHEMBL5435436 0.73 MAPT (0.56) TP53MAPTALOX15CYP2C9RECQL
SCHEMBL5674346 0.72 TP53 (0.41) GSK3BTP53MAPTCACNB4CACNA1A
SCHEMBL4589633 0.72 TSHR (0.41) TP53MAPTALOX15CYP2C9RECQL

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