SCHEMBL9689339

SCHEMBL9689339

COC(=O)C(CCn1cccc1C(=O)c1ccsc1)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
PLAU P00749 1/20 0.36
ELANE P08246 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 3/20 0.35
CNR2 P34972 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.33
HTR1A P08908 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL9687989 0.90 ELANE (0.38) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9690007 0.84 RECQL (0.54) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9689245 0.81 HPGD (0.46) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL9687969 0.81 NPC1 (0.52) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9689112 0.80 NPC1 (0.40) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL9690049 0.79 ALDH1A1 (0.39) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9792189 0.79 ELANE (0.34) ALDH1A1LMNAPLAUELANETSHR
SCHEMBL9689149 0.78 LMNA (0.39) MEN1ALDH1A1LMNAMAPTKMT2A
SCHEMBL9687966 0.78 TAS1R3 (0.42) MEN1ALDH1A1LMNAMAPTALOX12
SCHEMBL9689163 0.77 RECQL (0.43) 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