SCHEMBL9689958

SCHEMBL9689958

Cc1cccc(C(=O)c2cccn2CCC2C(=O)OC(C)(C)OC2=O)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 2/20 0.37
ALOX12 P18054 1/20 0.37
RECQL P46063 1/20 0.37
POLB P06746 1/20 0.34
PARP1 P09874 1/20 0.33
VNN1 O95497 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 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
SCHEMBL8812100 0.88 RECQL (0.50) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9792291 0.83 MEN1 (0.35) ALDH1A1MEN1KMT2APOLBPARP1
SCHEMBL9689213 0.82 KMT2A (0.39) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9690069 0.80 MEN1 (0.34) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9688851 0.80 NPSR1 (0.48) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9689799 0.80 MAPT (0.36) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9689156 0.78 NPSR1 (0.32) LMNA
SCHEMBL9689783 0.78 TSHR (0.36) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9688824 0.78 TSHR (0.38) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9688156 0.76 MAPT (0.46) ALDH1A1MAPTMEN1KMT2ALMNA

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