SCHEMBL7466189

SCHEMBL7466189

O=C1Nc2ccc(Cl)cc2C1(O)CC1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.58
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CBX7 O95931 2/20 0.49
CDYL Q9Y232 2/20 0.49
CDYL2 Q8N8U2 1/20 0.49
CDY1; CDY1B Q9Y6F8 1/20 0.49
PDE7A Q13946 1/20 0.43
POLB P06746 2/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
PGR P06401 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
AKR1B1 P15121 3/20 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
SCHEMBL7468658 0.84 PDE7A (0.45) IDO1MEN1KMT2ACBX7CDYL
SCHEMBL7465910 0.81 MEN1 (0.43) IDO1MEN1KMT2ACBX7CDYL
SCHEMBL7472300 0.77 BRD4 (0.56) IDO1MEN1KMT2ACBX7CDYL
SCHEMBL7348224 0.74 MEN1 (0.48) IDO1MEN1KMT2APDE7APOLB
SCHEMBL1320952 0.74 PDE7A (0.43) MEN1KMT2APDE7AOPRM1OPRK1
SCHEMBL7467192 0.73 MEN1 (0.36) IDO1MEN1KMT2APDE7APOLB
SCHEMBL7472923 0.72 PDE7A (0.47) IDO1MEN1KMT2APDE7APOLB
SCHEMBL16377143 0.71 IDO1 (0.62) IDO1MEN1KMT2ACBX7CDYL
SCHEMBL2495439 0.71 IDO1 (0.62) IDO1MEN1KMT2ACBX7CDYL
SCHEMBL7469889 0.71 BRD4 (0.47) IDO1MEN1KMT2APDE7APOLB

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