SCHEMBL15599161

SCHEMBL15599161

CCc1cnc(OC(C)C)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 7/20 0.40
CSNK2A1 P68400 2/20 0.39
S1PR5 Q9H228 2/20 0.38
SCN9A Q15858 4/20 0.37
S1PR3 Q99500 1/20 0.37
DHODH Q02127 1/20 0.37
ACACB O00763 1/20 0.37
RORC P51449 4/20 0.35
RORB Q92753 1/20 0.34
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33

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
SCHEMBL18682237 0.87 S1PR1 (0.43) S1PR1CSNK2A1S1PR5SCN9AS1PR3
SCHEMBL16758859 0.86 S1PR1 (0.40) S1PR1CSNK2A1S1PR5SCN9AS1PR3
SCHEMBL21031212 0.85 HCRTR1 (0.44) SCN9ARORCHCRTR1HCRTR2
SCHEMBL10088548 0.85 S1PR1 (0.42) S1PR1CSNK2A1S1PR5SCN9AS1PR3
SCHEMBL17069282 0.82 S1PR1 (0.38) S1PR1CSNK2A1S1PR5SCN9AS1PR3
SCHEMBL15599250 0.81 SCN9A (0.43) SCN9A
SCHEMBL10332075 0.80 SMN1; SMN2 (0.39) HCRTR1HCRTR2
SCHEMBL16770868 0.80 RORC (0.42) S1PR1CSNK2A1S1PR5SCN9AS1PR3
SCHEMBL19446089 0.78 PTGS2 (0.43) S1PR1DHODH
SCHEMBL18400155 0.77 PTGS2 (0.36) SCN9A

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
US-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LIMITED (IN) 2019-09-12 US disclosed
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LTD (IN) 2019-05-30 US disclosed
WO-2018020474-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS LUPIN LIMITED (IN) 2018-02-01 WO disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 US disclosed
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-03-30 US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 US disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 US disclosed
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 WO disclosed
WO-2014008458-A2 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2014-01-09 WO 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-20190275012-A9 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO S1PR1 3597/4885CSNK2A1 955/4885S1PR5 4510/4885
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, RRM1 S1PR1 2295/4885CSNK2A1 934/4885S1PR5 2124/4885
US-20190160045-A1 SUBSTITUTED THIAZOLO-PYRIDINE COMPOUNDS AS MALT1 INHIBITORS MALT1, PTP4A1, PTPRO S1PR1 3597/4885CSNK2A1 955/4885S1PR5 4510/4885
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF C1R, SRR, PNISR S1PR1 857/4885CSNK2A1 1478/4885S1PR5 960/4885

“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.