SCHEMBL7460367

SCHEMBL7460367

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.48
MAPT P10636 5/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PDK2 Q15119 2/20 0.39
TP53 P04637 2/20 0.39
ADCY8 P40145 1/20 0.39
CYP3A4 P08684 2/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 2/20 0.37
ESR2 Q92731 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MDM2 Q00987 1/20 0.36
PGR P06401 1/20 0.36
BRD4 O60885 1/20 0.35
HTR7 P34969 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL7467060 0.86 PGR (0.44) MAOBALDH1A1KMT2APGRKDM4E
SCHEMBL3226514 0.85 MAOB (0.48) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL7472037 0.84 MAOB (0.45) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL7474870 0.84 MAOB (0.45) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL3231150 0.84 MAOB (0.45) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL7467491 0.83 MAOB (0.44) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL3233582 0.82 MAOB (0.43) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL7476774 0.82 MAOB (0.43) MAOBMAPTALDH1A1SMN1; SMN2PDK2
SCHEMBL4595708 0.81 MAOB (0.48) MAOBMAPTALDH1A1SMN1; SMN2TP53
SCHEMBL1465028 0.81 MAOB (0.41) MAOBMAPTALDH1A1SMN1; SMN2MEN1

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