SCHEMBL689202

SCHEMBL689202

CCOC(=O)c1c(-c2cccc(F)c2)csc1N

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 10/20 0.73
ALDH1A1 P00352 9/20 0.69
MAPT P10636 6/20 0.69
MAPK1 P28482 2/20 0.69
HSD17B10 Q99714 6/20 0.64
HPGD P15428 2/20 0.64
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
ALOX15 P16050 3/20 0.62
USP2 O75604 1/20 0.62
PRKCI P41743 2/20 0.60
GAA P10253 1/20 0.59
KEAP1 Q14145 1/20 0.59
TDP1 Q9NUW8 2/20 0.57
MPI P34949 1/20 0.56
LMNA P02545 2/20 0.55
CASP1 P29466 1/20 0.55
CASP7 P55210 1/20 0.55

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
SCHEMBL689612 0.88 HSD17B10 (0.77) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL8288638 0.88 PRKCZ (0.72) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL8288636 0.86 ALDH1A1 (0.70) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL689305 0.86 ALDH1A1 (0.70) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL8289775 0.85 ALDH1A1 (0.69) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL689025 0.85 PRKCZ (0.73) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL3974980 0.85 ALDH1A1 (0.65) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL689204 0.85 PRKCZ (1.00) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL1190649 0.84 PRKCZ (0.80) PRKCZALDH1A1MAPTMAPK1HSD17B10
SCHEMBL689790 0.84 ALDH1A1 (0.78) PRKCZALDH1A1MAPTMAPK1HSD17B10

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
EP-2744812-B1 THERAPEUTICALLY ACTIVE FUSED PYRIMIDINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2016-07-20 EP disclosed
US-9227984-B2 Therapeutically active fused pyrimidine derivatives UCB PHARMA S.A. (BE) 2016-01-05 US disclosed
US-20140309222-A1 Therapeutically Active Fused Pyrimidine Derivatives KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2014-10-16 US disclosed
EP-2744812-A2 THERAPEUTICALLY ACTIVE FUSED PYRIMIDINE DERIVATIVES UCB Pharma, S.A. (BE) 2014-06-25 EP disclosed
WO-2013024291-A2 THERAPEUTICALLY ACTIVE FUSED PYRIMIDINE DERIVATIVES UCB PHARMA S.A. (BE) 2013-02-21 WO disclosed
WO-2012100732-A1 RETINOID-RELATED ORPHAN RECEPTOR GAMMA MODULATORS, COMPOSITION CONTAINING THEM AND USES THEREOF GLAXO GROUP LIMITED (GB) 2012-08-02 WO disclosed
EP-1953148-B1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2012-02-29 EP disclosed
US-7915267-B2 Heterocyclic amide compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-29 US disclosed
US-20090137603-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 US disclosed
EP-1953148-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2008-08-06 EP disclosed
US-20060183759-A1 Tissue transglutaminase inhibitors BRIGHAM AND WOMEN'S HOSPITAL, INC., THE 2006-08-17 US disclosed
WO-2006060702-A1 SUBSTITUED 3,4-DIHYDROTHIENO [2,3-D] PYRMIDINES AS TISSUE TRANSGLUTAMINASE INHIBITORS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2006-06-08 WO disclosed
WO-2005033102-A2 THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-04-14 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 (3 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-20140309222-A1 Therapeutically Active Fused Pyrimidine Derivatives HAVCR2, TPMT, PAICS PRKCZ 2221/4885ALDH1A1 1119/4885MAPT 3001/4885
US-20060183759-A1 Tissue transglutaminase inhibitors TGM2, HNMT, TPMT PRKCZ 3494/4885ALDH1A1 3116/4885MAPT 40/4885
US-20090137603-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF MMP2, MMP9, MMP1 PRKCZ 4810/4885ALDH1A1 423/4885MAPT 4287/4885

“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.