SCHEMBL7475744

SCHEMBL7475744

COc1ccc2c(c1)C(N)(c1ccccc1Cl)C(=O)N2

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.43
AKR1B1 P15121 1/20 0.41
ADAMTS5 Q9UNA0 2/20 0.41
AURKB Q96GD4 2/20 0.41
PLK4 O00444 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CBX7 O95931 1/20 0.41
CDYL Q9Y232 1/20 0.41
PDE7A Q13946 1/20 0.40
HTR6 P50406 2/20 0.40
KMT2A Q03164 2/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAOB P27338 2/20 0.39
KDM4E B2RXH2 1/20 0.39
CHEK1 O14757 1/20 0.38
WEE1 P30291 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
SCHEMBL7472037 0.86 MAOB (0.45) PGRALDH1A1KMT2AALOX15MAOB
SCHEMBL6543122 0.83 HTR6 (0.50) PGRAKR1B1ADAMTS5ALDH1A1CBX7
SCHEMBL7467060 0.83 PGR (0.44) PGRAKR1B1ADAMTS5AURKBPLK4
SCHEMBL7470907 0.82 AKR1C3 (0.47) PGRAKR1B1PDE7AHTR6KMT2A
SCHEMBL1464210 0.80 KMT2A (0.40) PGRAKR1B1ADAMTS5AURKBALDH1A1
SCHEMBL5675888 0.80 ADAMTS5 (0.47) PGRAKR1B1ADAMTS5CBX7CDYL
SCHEMBL5674398 0.77 KMT2A (0.39) AKR1B1KMT2A
SCHEMBL8588946 0.77 AKR1B1 (0.42) AKR1B1HTR6KMT2A
SCHEMBL9219145 0.77 PGR (0.36) PGRALDH1A1CBX7CDYLHTR6
SCHEMBL1797997 0.76 KMT2A (0.50) PGRADAMTS5ALDH1A1CBX7CDYL

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