SCHEMBL1379947

SCHEMBL1379947

O=c1c(C2=NS(=O)(=O)c3ccccc3N2)c(O)c2ccccc2n1NC1CCCC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.59
MAPK1 P28482 1/20 0.59
CYP2C9 P11712 4/20 0.52
NR1I2 O75469 1/20 0.52
MAPT P10636 1/20 0.44
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
GAA P10253 1/20 0.38
PPARG P37231 1/20 0.38
NCOA2 Q15596 1/20 0.38
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TAAR1 Q96RJ0 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL1377746 0.99 HSD17B10 (0.58) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1376870 0.99 HSD17B10 (0.58) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1522880 0.98 MAPK1 (0.59) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1379864 0.92 MAPK1 (0.57) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1523452 0.91 HSD17B10 (0.49) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1379953 0.91 HSD17B10 (0.48) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1377214 0.90 MAPK1 (0.56) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1523953 0.90 HSD17B10 (0.49) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1377749 0.90 HSD17B10 (0.47) HSD17B10MAPK1CYP2C9NR1I2MAPT
SCHEMBL1376876 0.90 HSD17B10 (0.47) HSD17B10MAPK1CYP2C9NR1I2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4738172-B2 2011-08-03 JP claimed
EP-1560827-A1 ANTI-INFECTIVE AGENTS Abbott Laboratories (US) 2005-08-10 EP claimed
US-20050075331-A1 Anti-infective agents ABBOTT LABORATORIES 2005-04-07 US claimed
US-20040167123-A1 Anti-infective agents ABBVIE INC. 2004-08-26 US claimed
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 US claimed
WO-2004041818-A1 ANTI-INFECTIVE AGENTS ABBOTT LABORATORIES (US) 2004-05-21 WO 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-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 (4 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-20040162285-A1 Anti-infective agents POLR1C, RPL5, POLB HSD17B10 1232/4885MAPK1 1456/4885CYP2C9 682/4885
US-20040167123-A1 Anti-infective agents SERPINB1, CYP51A1, ZC3HAV1 HSD17B10 1422/4885MAPK1 739/4885CYP2C9 1503/4885
US-20050075331-A1 Anti-infective agents RPL35, POLI, POLRMT HSD17B10 1335/4885MAPK1 2328/4885CYP2C9 1715/4885
US-20040087577-A1 Anti-infective agents POLR1C, RPL5, POLB HSD17B10 1232/4885MAPK1 1456/4885CYP2C9 682/4885

“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.