SCHEMBL7472301

SCHEMBL7472301

O=C1Nc2ccc(Cl)cc2C1=CC1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.69
LRRK2 Q5S007 6/20 0.53
TGM2 P21980 2/20 0.53
IDO1 P14902 2/20 0.53
TDO2 P48775 2/20 0.53
PSEN1 P49768 2/20 0.51
PSEN2 P49810 2/20 0.51
APH1B Q8WW43 2/20 0.51
NCSTN Q92542 2/20 0.51
APH1A Q96BI3 2/20 0.51
PSENEN Q9NZ42 2/20 0.51
CES1 P23141 1/20 0.50
PDGFRB P09619 1/20 0.50
HSP90AA1 P07900 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
RPS6KA3 P51812 1/20 0.49
RET P07949 1/20 0.48
MDM2 Q00987 1/20 0.47

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
SCHEMBL7472296 1.00 MAPT (0.69) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL249877 0.89 MAPT (0.55) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL3366346 0.89 MAPT (0.55) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL249878 0.89 MAPT (0.55) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL250464 0.87 MAPT (0.56) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL250463 0.87 MAPT (0.56) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL3365456 0.87 MAPT (0.56) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL28879745 0.82 MAPT (0.61) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL30452131 0.82 MAPT (0.61) MAPTLRRK2TGM2IDO1TDO2
SCHEMBL25825365 0.82 MAPT (0.48) MAPTLRRK2TGM2IDO1TDO2

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