SCHEMBL7469475

SCHEMBL7469475

CCN(CC)CCNC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.39
AKR1C3 P42330 1/20 0.38
ADCY8 P40145 1/20 0.38
PGR P06401 1/20 0.37
HTR7 P34969 2/20 0.37
MGAM O43451 1/20 0.37
HTR1A P08908 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
HTR2A P28223 1/20 0.37
HTR6 P50406 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
CBX7 O95931 1/20 0.36
CDYL2 Q8N8U2 1/20 0.36
CDYL Q9Y232 1/20 0.36
CDY1; CDY1B Q9Y6F8 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
PDGFRB P09619 2/20 0.36
KIT P10721 2/20 0.36

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
SCHEMBL7468365 0.87 IDO1 (0.43) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7460781 0.86 ALDH1A1 (0.39) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7466391 0.85 IDO1 (0.45) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7475642 0.84 PGR (0.41) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7462490 0.83 GHSR (0.42) IDO1ADCY8HTR7MGAMHTR1A
SCHEMBL7468352 0.83 ADCY8 (0.42) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7468999 0.82 BRD4 (0.44) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7475677 0.82 IDO1 (0.41) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7471107 0.82 MEN1 (0.42) IDO1AKR1C3ADCY8PGRHTR7
SCHEMBL7465487 0.82 IDO1 (0.37) IDO1AKR1C3ADCY8PGRHTR7

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