SCHEMBL14587294

SCHEMBL14587294

c1scc2c1OCCOCCOCCO2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
CRHBP P24387 2/20 0.52
CRHR2 Q13324 2/20 0.52
HTT P42858 2/20 0.52
MAPT P10636 7/20 0.41
BLM P54132 1/20 0.41
KDM4E B2RXH2 4/20 0.40
GAA P10253 3/20 0.40
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
KMT2A Q03164 2/20 0.33
TTR P02766 1/20 0.33
MEN1 O00255 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
NPC1 O15118 1/20 0.31
USP2 O75604 1/20 0.31
TP53 P04637 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL15982300 1.00 LMNA (0.52) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL15981871 1.00 LMNA (0.52) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL14587292 1.00 LMNA (0.52) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL15981877 1.00 LMNA (0.52) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL456419 0.91 ITGB2 (0.45) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL33274 0.91
SCHEMBL15982301 0.89 LMNA (0.74) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL15981881 0.89 LMNA (0.74) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL15981864 0.89 LMNA (0.74) LMNASMN1; SMN2CRHBPCRHR2HTT
SCHEMBL25248367 0.88 ITGB2 (0.43) LMNASMN1; SMN2CRHBPCRHR2HTT

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
US-7183419-B2 Reacting a 2,5-di(alkoxycarbonyl)-3,4-dihydroxythiophene or the alkali metal salt thereof with a ditosylate and cleaving the ester and decarboxylating the intermediate thus formed; used as monomers for pi-conjugated polymers H.C. STARCK GMBH & CO. KG (DE) 2007-02-27 US disclosed
US-7183419-B2 Reacting a 2,5-di(alkoxycarbonyl)-3,4-dihydroxythiophene or the alkali metal salt thereof with a ditosylate and cleaving the ester and decarboxylating the intermediate thus formed; used as monomers for pi-conjugated polymers H.C. STARCK GMBH & CO. KG (DE) 2007-02-27 US disclosed