SCHEMBL7470907

SCHEMBL7470907

NC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.47
MGAM O43451 1/20 0.46
HTR1A P08908 1/20 0.46
GAA P10253 1/20 0.46
SI P14410 1/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
HTR6 P50406 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
IDO1 P14902 2/20 0.43
PGR P06401 5/20 0.40
AKR1B1 P15121 4/20 0.40
AKR1A1 P14550 1/20 0.40
MAPT P10636 1/20 0.40
ADCY8 P40145 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE7A Q13946 1/20 0.38
CHEK1 O14757 1/20 0.38
BRD4 O60885 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
SCHEMBL7470395 0.85 IDO1 (0.45) AKR1C3MGAMHTR1AGAASI
SCHEMBL7467265 0.83 BRD4 (0.52) MGAMHTR1AGAASIHTR2A
SCHEMBL27510705 0.82 IDO1 (0.42) MGAMHTR1AGAASIHTR2A
SCHEMBL1797997 0.82 KMT2A (0.50) MGAMHTR1AGAASIHTR2A
SCHEMBL7475744 0.82 PGR (0.43) HTR6PGRAKR1B1KMT2APDE7A
SCHEMBL5430507 0.80 AKR1C3 (0.48) AKR1C3MGAMHTR1AGAASI
SCHEMBL5674398 0.79 KMT2A (0.39) HTR7AKR1B1MAPTMEN1KMT2A
SCHEMBL8588946 0.79 AKR1B1 (0.42) HTR7HTR6AKR1B1MAPTADCY8
SCHEMBL5675223 0.79 GAA (0.43) MGAMHTR1AGAASIHTR2A
SCHEMBL7472037 0.79 MAOB (0.45) HTR7PGRMAPTADCY8MEN1

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