SCHEMBL8669676

SCHEMBL8669676

O=C(O)C1=CCS[C@H]2C(=S)C(=O)N12

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
APEX1 P27695 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC15A2 Q16348 1/20 0.35
NR1I2 O75469 1/20 0.35
PGR P06401 1/20 0.35
PTGS2 P35354 1/20 0.35
SPOP O43791 1/20 0.32
HTR7 P34969 1/20 0.30

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
SCHEMBL3949607 0.85 KDM4E (0.33) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL3949605 0.85 KDM4E (0.33) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL10429508 0.78 KDM4E (0.32) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL4048939 0.77 KDM4E (0.30) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL4048933 0.77 KDM4E (0.30) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL11130790 0.77 NR1I2 (0.32) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL1387526 0.73 KDM4E (0.34) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL3188369 0.73 KDM4E (0.34) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL8590684 0.73 KDM4E (0.34) KDM4EALDH1A1CYP3A4MAPTAPEX1
SCHEMBL1387528 0.73 KDM4E (0.34) KDM4EALDH1A1CYP3A4MAPTAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9278778-A None JP disclosed
EP-0882052-A1 NEW CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed
JP-H09278778-A ANTI-MRSA CEPHALOSPORIN COMPOUND KYORIN PHARMACEUT CO LTD 1997-10-28 JP disclosed
EP-0796263-A1 CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-09-24 EP disclosed
WO-1997029111-A1 NEW CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-14 WO disclosed
WO-1996017850-A1 CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-06-13 WO disclosed
EP-0057422-B1 NEW CEPHEM COMPOUNDS, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-10-12 EP disclosed
US-4066641-A METHOD FOR CYCLIZATION TO GIVE CEPHEM RING HAMASHIMA YOSHIO 1978-01-03 US disclosed