SCHEMBL9687966

SCHEMBL9687966

C=Cc1ccc(C(=O)c2cccn2CCC(C(=O)OC)C(=O)OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARG P37231 3/20 0.38
PPARA Q07869 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CNR2 P34972 1/20 0.34
GFER P55789 1/20 0.34

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
SCHEMBL9687992 0.90 ALDH1A1 (0.39) TAS1R3TAS1R1MEN1ALDH1A1LMNA
SCHEMBL9690007 0.86 RECQL (0.54) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9687969 0.85 NPC1 (0.52) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9689112 0.79 NPC1 (0.40) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL9792312 0.79 TAS1R3 (0.41) TAS1R3TAS1R1ALDH1A1PPARG
SCHEMBL9689339 0.78 MEN1 (0.36) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9690049 0.78 ALDH1A1 (0.39) TAS1R3TAS1R1MEN1ALDH1A1LMNA
SCHEMBL9688742 0.78 LMNA (0.46) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9689317 0.78 LMNA (0.46) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9688779 0.78 RECQL (0.46) MEN1ALDH1A1LMNAMAPTALOX12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486807-A1 Process for preparing 5-aroyl-2,3-dihydro-1H-pyrrolizine-1,1-dicarboxylates SYNTEX (U.S.A.) INC. (US) 1992-05-27 EP disclosed
US-5082951-A Process for preparing 5-aroyl-2,3-dihydro-1H-pyrrolizine-1,1-dicarboxylates (I) and intermediates therefor SYNTEX (U.S.A.) INC. (US) 1992-01-21 US disclosed