SCHEMBL9689296

SCHEMBL9689296

CN(C)C(=O)c1ccsc1C=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ERN1 O75460 3/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 5/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 2/20 0.34
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 2/20 0.33
MAPT P10636 2/20 0.33
KEAP1 Q14145 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 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
SCHEMBL5549783 0.76 MEN1 (0.44) GAAHSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL4164473 0.75 NAMPT (0.41) GAAHSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL3252627 0.75 ALDH1A1 (0.55) GAAHSD17B10ERN1KMT2AMEN1
SCHEMBL3253578 0.75 MEN1 (0.36) GAAHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL8464477 0.74 KMT2A (0.49) GAAKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL9350639 0.73 ALDH1A1 (0.59) GAAHSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL10493783 0.73 ALDH1A1 (0.38) GAAHSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL16993652 0.70 KMT2A (0.37) GAAHSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL8628177 0.70 TSHR (0.50) GAAHSD17B10KMT2AMEN1ALDH1A1
SCHEMBL8565732 0.70 CA12 (0.36) GAAKMT2AMEN1SMN1; SMN2ALDH1A1

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 6 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
US-4458081-A ANTIINFLAMMATORY, ANALGESIC, ANTICOAGULANT, MUSCLE RELAXANT SYNTEX (U.S.A.) INC. (US) 1984-07-03 US disclosed
US-4454326-A 5-Aroyl 6-chloro or 6-bromo 1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1,1-di-carboxylates SYNTEX (U.S.A.) INC. (US) 1984-06-12 US disclosed
US-4347187-A Process for preparing 5-aroyl 1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-1-carboxylic acids and novel intermediates therein SYNTEX (U.S.A.) INC. (US) 1982-08-31 US disclosed
US-4347186-A Process for preparing 5-aroyl 1,2-dihydro-3-H pyrrolo[1,2-a]pyrrole-1-carboxylic acids and novel intermediates therein SYNTEX (U.S.A.) INC. (US) 1982-08-31 US disclosed