SCHEMBL7462897

SCHEMBL7462897

CCOc1ccc2c(c1)C(c1ccccc1Cl)C(=O)N2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.54
TP53 P04637 5/20 0.54
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.39
MAOB P27338 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
CASP1 P29466 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
SLC8B1 Q6J4K2 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MDM2 Q00987 1/20 0.38
PGR P06401 1/20 0.38
FFAR2 O15552 1/20 0.38

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
SCHEMBL5431073 0.86 CDYL2 (0.43) MAPTTP53ALDH1A1SMN1; SMN2TSHR
SCHEMBL7467669 0.83 BRD4 (0.48) MAPTTP53ALDH1A1SMN1; SMN2LMNA
SCHEMBL5678203 0.79 MAPT (0.44) MAPTTP53ALDH1A1SMN1; SMN2TSHR
SCHEMBL5435436 0.78 MAPT (0.56) MAPTTP53LMNATSHRCYP1A2
SCHEMBL5674380 0.78 TP53 (0.48) MAPTTP53ALDH1A1SMN1; SMN2LMNA
SCHEMBL7852811 0.76 IDO1 (0.49) MAPTTP53ALDH1A1SMN1; SMN2TSHR
SCHEMBL7471103 0.76 MAPT (0.41) MAPTTP53ALDH1A1SMN1; SMN2TSHR
SCHEMBL11514976 0.76 PGR (0.47) MAPTTP53ALDH1A1SMN1; SMN2LMNA
SCHEMBL4589633 0.75 TSHR (0.41) MAPTTP53ALDH1A1SMN1; SMN2TSHR
SCHEMBL4589629 0.74 SMN1; SMN2 (0.40) MAPTTP53ALDH1A1SMN1; SMN2LMNA

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