SCHEMBL19815050

SCHEMBL19815050

CC(O)CC(C(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RNPEP Q9H4A4 1/20 0.42
SLC7A5 Q01650 1/20 0.42
ENPEP Q07075 1/20 0.40
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
OR51E2 Q9H255 1/20 0.36

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
SCHEMBL11131728 0.86 TP53 (0.43) TP53LMNAGAASMN1; SMN2RNPEP
Bicarbonate SCHEMBL15411238 0.80 TP53 (0.47) TP53LMNAGAASMN1; SMN2RNPEP
SCHEMBL9410931 0.80 TP53 (0.38) TP53LMNAGAASMN1; SMN2RNPEP
Hydroxyamine SCHEMBL20817080 0.79 SLC7A5 (0.59) LMNARNPEPSLC7A5ENPEPSLC1A3
SCHEMBL165532 0.79
SCHEMBL701328 0.79
SCHEMBL28172667 0.79
SCHEMBL9418997 0.79 SLC1A3 (0.50) TP53RNPEPSLC7A5SLC1A3SLC1A2
SCHEMBL1200181 0.78 RNPEP (0.57) TP53LMNARNPEPSLC7A5SLC1A3
SCHEMBL30019003 0.78 TP53 (0.44) TP53RNPEPSLC7A5ENPEPSLC1A3

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
EP-3491044-A1 METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS Versalis S.p.A. (IT) 2019-06-05 EP disclosed
WO-2018020440-A9 METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS VERSALIS S.P.A. (IT) 2019-03-07 WO disclosed
WO-2018020440-A1 METHOD OF REGIOSELECTIVE SYNTHESIS OF POLYESTERS FROM ASYMMETRIC DIOLS VERSALIS S.P.A. (IT) 2018-02-01 WO disclosed
CN-103764653-A Compounds and compositions as c-Kit kinase inhibitors IRM LLC 2014-04-30 CN disclosed
CN-103687855-A Imidazole derivatives INTERVET INT BV 2014-03-26 CN disclosed