SCHEMBL7474852

SCHEMBL7474852

O=C1Nc2ccc(Cl)cc2C1(NCc1ccccc1)c1ccccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.42
AKR1C3 P42330 1/20 0.41
IDO1 P14902 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR7 P34969 2/20 0.40
MGAM O43451 1/20 0.40
HTR1A P08908 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
HTR2A P28223 1/20 0.40
HTR6 P50406 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
ALDH1A1 P00352 1/20 0.38
MAOB P27338 1/20 0.37
CBX7 O95931 1/20 0.37
CDYL2 Q8N8U2 1/20 0.37
CDYL Q9Y232 1/20 0.37
CDY1; CDY1B Q9Y6F8 1/20 0.37
MAPT P10636 1/20 0.37

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 0.85 IDO1 (0.45) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7465774 0.84 IDO1 (0.48) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7468365 0.82 IDO1 (0.43) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7468999 0.82 BRD4 (0.44) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7464164 0.82 IDO1 (0.43) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7477321 0.81 IDO1 (0.42) PGRAKR1C3IDO1HTR7MGAM
SCHEMBL7474082 0.81 IDO1 (0.42) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7466055 0.80 AKR1C3 (0.45) PGRAKR1C3IDO1MEN1KMT2A
SCHEMBL7475677 0.80 IDO1 (0.41) PGRAKR1C3IDO1HTR7MGAM
SCHEMBL7475642 0.80 PGR (0.41) PGRAKR1C3IDO1MEN1KMT2A

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 3 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