SCHEMBL5568533

SCHEMBL5568533

O=C(O)c1sccc1-c1cccs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
GAA P10253 3/20 0.47
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
DAO P14920 1/20 0.45
BCAT2 O15382 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
USP2 O75604 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
GPR35 Q9HC97 3/20 0.41
PTPN1 P18031 2/20 0.41
PTPN2 P17706 1/20 0.41
PTPRC P08575 1/20 0.40
KEAP1 Q14145 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40

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
SCHEMBL5877488 0.83 KDM4E (0.50) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL27849216 0.82 KDM4E (0.43) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL24611526 0.79 MAPT (0.56) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL27575569 0.79 MAPT (0.40) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL1670982 0.76 BCAT2 (0.72) ALDH1A1TSHRBCAT2MEN1KMT2A
SCHEMBL361451 0.75 KDM4E (0.44) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL16429514 0.74 KDM4E (0.54) KDM4EMAPTALDH1A1GAAHPGD
SCHEMBL1823757 0.74 GPR35 (0.52) KDM4EMAPTALDH1A1GAAHPGD
Acetic Acid SCHEMBL367778 0.74 KDM4E (0.45) KDM4EMAPTALDH1A1GAAHPGD
Hydrochloric Acid SCHEMBL1825977 0.73 GPR35 (0.51) KDM4EMAPTALDH1A1GAAHPGD

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023074408-A1 THIOPHENE COMPOUND, METHOD FOR SYNTHESIZING SAME, AND COMPOSITION CONTAINING SAID THIOPHENE COMPOUND 四国化成工業株式会社 2023-05-04 WO disclosed
EP-1819719-A2 OLIGONUCLEOTIDE PROBES CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 2007-08-22 EP disclosed
WO-2006051397-A2 OLIGONUCLEOTIDE PROBES CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 2006-05-18 WO disclosed
US-6645976-B1 Nonpancreatic secretory phospholipase (sPLA2) supressors such as 2-(3-Benzyl-8-hydroxy-2-ethylindolizin-1-yl)acetamide, administered to control release of fatty acid and prevent the arachidonic acid cascade; septic shock ELI LILLY AND COMPANY 2003-11-11 US disclosed
EP-0772596-B1 INDOLIZINE sPLA2 INHIBITORS LILLY CO ELI (US) 2003-10-01 EP disclosed
EP-0772596-A4 INDOLIZINE sPLA2 INHIBITORS LILLY CO ELI (US) 1999-01-13 EP disclosed
CN-1158121-A Indolizine sPLA2Inhibitors LILLY CO ELI (US) 1997-08-27 CN disclosed
EP-0772596-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1997-05-14 EP disclosed
WO-1996003383-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-08 WO disclosed