SCHEMBL1522580

SCHEMBL1522580

O=c1c(C2=NS(O)(O)c3ccccc3N2)c(O)c2cccnc2n1Cc1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PKM P14618 3/20 0.42
MAPK10 P53779 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41
GABRA5 P31644 2/20 0.41
CNR2 P34972 4/20 0.41
CNR1 P21554 1/20 0.41
ALOX5 P09917 1/20 0.38
CYP2C9 P11712 2/20 0.37
NR1I2 O75469 1/20 0.37
GABRA1 P14867 1/20 0.36
KDM4E B2RXH2 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SRC P12931 1/20 0.35
KMT2A Q03164 2/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL1522476 0.93 CNR2 (0.47) MAPK1HSD17B10PTGDR2CNR2CNR1
SCHEMBL1522581 0.91 MAPK1 (0.54) MAPK1HSD17B10PKMMAPK10PTGDR2
SCHEMBL1522693 0.91 MAPK1 (0.45) MAPK1HSD17B10PTGDR2CNR2CNR1
SCHEMBL1522598 0.89 MAPK1 (0.41) MAPK1HSD17B10PKMMAPK10PTGDR2
SCHEMBL1523311 0.89 MAPK1 (0.43) MAPK1HSD17B10PTGDR2GABRA5CNR2
SCHEMBL1522268 0.88 MAPK1 (0.43) MAPK1HSD17B10PTGDR2CNR2CNR1
SCHEMBL1522330 0.88 MAPK1 (0.44) MAPK1HSD17B10PTGDR2CNR2CNR1
SCHEMBL1523090 0.88 MAPK1 (0.44) MAPK1HSD17B10CNR2CNR1CYP2C9
SCHEMBL1522192 0.88 MAPK1 (0.46) MAPK1HSD17B10PTGDR2CNR2CNR1
SCHEMBL1522696 0.87 PTGDR2 (0.44) MAPK1HSD17B10MAPK10PTGDR2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 US claimed
US-20040097492-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-20 US claimed
US-20040087577-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-06 US claimed
EP-2361913-A1 Anti-infective agents Abbott Laboratories (US) 2011-08-31 EP disclosed
US-7902203-B2 Anti-infective agents ABBOTT LABORATORIES, INC. (US) 2011-03-08 US disclosed
EP-1560827-B1 ANTI-INFECTIVE AGENTS ABBOTT LAB (US) 2010-12-29 EP disclosed
EP-1560827-A1 ANTI-INFECTIVE AGENTS Abbott Laboratories (US) 2005-08-10 EP disclosed
US-20050075331-A1 Anti-infective agents ABBOTT LABORATORIES 2005-04-07 US disclosed
US-20040167123-A1 Anti-infective agents ABBVIE INC. 2004-08-26 US disclosed
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 US disclosed
WO-2004041818-A1 ANTI-INFECTIVE AGENTS ABBOTT LABORATORIES (US) 2004-05-21 WO disclosed
US-20040097492-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-20 US disclosed
US-20040087577-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040097492-A1 Anti-infective agents POLR1C, RPL5, POLB MAPK1 1456/4885HSD17B10 1232/4885PKM 3404/4885
US-20040162285-A1 Anti-infective agents POLR1C, RPL5, POLB MAPK1 1456/4885HSD17B10 1232/4885PKM 3404/4885
US-20040167123-A1 Anti-infective agents SERPINB1, CYP51A1, ZC3HAV1 MAPK1 739/4885HSD17B10 1422/4885PKM 4138/4885
US-20050075331-A1 Anti-infective agents RPL35, POLI, POLRMT MAPK1 2328/4885HSD17B10 1335/4885PKM 3917/4885
US-20040087577-A1 Anti-infective agents POLR1C, RPL5, POLB MAPK1 1456/4885HSD17B10 1232/4885PKM 3404/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.