SCHEMBL3267161

SCHEMBL3267161

NC(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.62
PRSS1 P07477 3/20 0.62
PRSS2 P07478 3/20 0.62
PRSS3 P35030 3/20 0.62
L3MBTL1 Q9Y468 1/20 0.59
LARS1 Q9P2J5 1/20 0.58
LMNA P02545 3/20 0.57
KAT6A Q92794 4/20 0.55
SLC1A3 P43003 1/20 0.55
SLC1A2 P43004 1/20 0.55
SLC1A1 P43005 1/20 0.55
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
RAPGEF3 O95398 1/20 0.52
CA2 P00918 1/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
NLRP3 Q96P20 1/20 0.51
ATM Q13315 1/20 0.50

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
SCHEMBL11032473 0.86 L3MBTL1 (0.62) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL7774671 0.84 L3MBTL1 (0.61) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL11162145 0.83 L3MBTL1 (0.64) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL3267159 0.83 L3MBTL1 (0.59) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL29492938 0.83 L3MBTL1 (0.64) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL6848742 0.82 RAPGEF3 (0.59) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL7610253 0.81 L3MBTL1 (0.61) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL3469824 0.81 F2 (0.56) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL19630986 0.80 L3MBTL1 (0.65) F2PRSS1PRSS2PRSS3L3MBTL1
SCHEMBL30549044 0.80 RAPGEF3 (0.60) F2PRSS1PRSS2PRSS3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60204706-A None JP disclosed
EP-1740584-B9 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2010-06-09 EP disclosed
US-20090275568-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-05 US disclosed
US-20090270625-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMTED (JP) 2009-10-29 US disclosed
US-20090258893-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-15 US disclosed
US-7592453-B2 Fused quinoline derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-22 US disclosed
EP-2080760-A1 Fused quinoline derivative and use thereof Takeda Pharmaceutical Company Limited (JP) 2009-07-22 EP disclosed
EP-1740584-B1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2008-12-03 EP disclosed
US-20080039452-A1 Fused Quinoline Derivative and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-02-14 US disclosed
EP-1740584-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-01-10 EP disclosed
WO-2005105802-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-10 WO disclosed
JP-S60204706-A HERBICIDE TEIJIN LTD 1985-10-16 JP 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-20090275568-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TACR2, HRH3, HRH2 F2 2210/4885PRSS1 1840/4885PRSS2 825/4885
US-20090258893-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TACR2, HRH3, HRH2 F2 2210/4885PRSS1 1840/4885PRSS2 825/4885
US-20080039452-A1 Fused Quinoline Derivative and Use Thereof TACR2, HRH3, HRH2 F2 2157/4885PRSS1 1808/4885PRSS2 759/4885
US-20090270625-A1 FUSED QUINOLINE DERIVATIVE AND USE THEREOF TACR2, HRH3, HRH2 F2 2237/4885PRSS1 1760/4885PRSS2 753/4885

“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.