SCHEMBL8626022

SCHEMBL8626022

Cn1c(=O)oc2cc(C(=O)c3ccccc3)cnc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.63
HPGD P15428 2/20 0.63
SIGMAR1 Q99720 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.43
GLA P06280 1/20 0.43
GRM5 P41594 1/20 0.40
ALOX15 P16050 2/20 0.40
HTT P42858 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
RECQL P46063 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 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
SCHEMBL8626905 0.82 ALDH1A1 (0.43) ALDH1A1HPGDSIGMAR1SMN1; SMN2HTT
SCHEMBL8917897 0.79 SIGMAR1 (0.42) ALDH1A1HPGDSIGMAR1SMN1; SMN2KDM4E
SCHEMBL8625701 0.78 ALDH1A1 (0.40) ALDH1A1HPGDSIGMAR1MEN1KMT2A
SCHEMBL8700563 0.77 ALDH1A1 (1.00) ALDH1A1HPGDSIGMAR1SMN1; SMN2GLA
SCHEMBL8919271 0.76 ALDH1A1 (0.53) ALDH1A1HPGDKMT2AKDM4EL3MBTL1
SCHEMBL8919693 0.76 POLB (0.46) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL8921700 0.76 ALDH1A1 (0.42) ALDH1A1HPGDSMN1; SMN2HTTMEN1
SCHEMBL8625812 0.75 SIGMAR1 (0.42) ALDH1A1HPGDSIGMAR1L3MBTL1LMNA
SCHEMBL14565098 0.74 ALDH1A1 (0.79) ALDH1A1HPGDSIGMAR1SMN1; SMN2GLA
SCHEMBL19023154 0.74 HPGD (0.37) ALDH1A1HPGDGLAHTTMEN1

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
US-5618819-A ANALGESICS ADIR ET COMPAGNIE (FR) 1997-04-08 US claimed
EP-0691339-A1 Amine derivatives of 1,3-dihydro-2H-pyrrolo(2,3-b)pyridin-2-ones and oxazolo(4,5-b)pyridin-2(3H)-ones, their process of preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-01-10 EP claimed
US-5767128-A ANALGESICS ADIR ET COMPAGNIE (FR) 1998-06-16 US disclosed
US-5618819-A ANALGESICS ADIR ET COMPAGNIE (FR) 1997-04-08 US disclosed
EP-0691339-A1 Amine derivatives of 1,3-dihydro-2H-pyrrolo(2,3-b)pyridin-2-ones and oxazolo(4,5-b)pyridin-2(3H)-ones, their process of preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-01-10 EP disclosed