SCHEMBL7465487

SCHEMBL7465487

CN(C)CCOCCNC1(c2ccccc2Cl)C(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.37
GAA P10253 2/20 0.37
HTR7 P34969 2/20 0.37
MGAM O43451 1/20 0.37
HTR1A P08908 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
AKR1C3 P42330 1/20 0.36
PSEN1 P49768 3/20 0.36
PSEN2 P49810 3/20 0.36
APH1B Q8WW43 3/20 0.36
NCSTN Q92542 3/20 0.36
APH1A Q96BI3 3/20 0.36
PSENEN Q9NZ42 3/20 0.36
ADCY8 P40145 1/20 0.36
LRRK2 Q5S007 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 2/20 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
SCHEMBL7475677 0.86 IDO1 (0.41) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7474704 0.84 AKR1C3 (0.38) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7462806 0.83 AKR1C3 (0.40) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7468365 0.82 IDO1 (0.43) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7468067 0.82 IDO1 (0.39) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7469475 0.82 IDO1 (0.39) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7467311 0.81 IDO1 (0.44) IDO1ADCY8KDM4EALDH1A1SMN1; SMN2
SCHEMBL7460781 0.81 ALDH1A1 (0.39) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7468999 0.80 BRD4 (0.44) IDO1GAAHTR7MGAMHTR1A
SCHEMBL7466391 0.80 IDO1 (0.45) IDO1GAAHTR7MGAMHTR1A

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 4 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-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