SCHEMBL7476774

SCHEMBL7476774

CCNC1(c2ccccc2Cl)C(=O)Nc2ccc(OCC)cc21

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.43
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 2/20 0.37
ADCY8 P40145 1/20 0.37
PDK2 Q15119 2/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37
CYP3A4 P08684 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
ESR2 Q92731 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MDM2 Q00987 1/20 0.35
IP6K1 Q92551 1/20 0.34
PGR P06401 1/20 0.34

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
SCHEMBL7466391 0.84 IDO1 (0.45) ADCY8GRIN1GRIN2AMEN1KMT2A
SCHEMBL3226514 0.82 MAOB (0.48) MAOBMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7460367 0.82 MAOB (0.48) MAOBMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7474870 0.81 MAOB (0.45) MAOBMAPTALDH1A1SMN1; SMN2TP53
SCHEMBL7472037 0.81 MAOB (0.45) MAOBMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL3231150 0.81 MAOB (0.45) MAOBMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7467491 0.80 MAOB (0.44) MAOBMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL3233582 0.79 MAOB (0.43) MAOBMAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7468365 0.75 IDO1 (0.43) ADCY8GRIN1GRIN2AMEN1KMT2A
SCHEMBL8592741 0.73 ADCY8 (0.50) ALDH1A1ADCY8MEN1KMT2A

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