SCHEMBL6460146

SCHEMBL6460146

CCOC(=O)CS(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.58
KMT2A Q03164 3/20 0.54
HPGD P15428 3/20 0.52
NPSR1 Q6W5P4 3/20 0.52
MAPT P10636 2/20 0.52
TP53 P04637 2/20 0.52
MAPK1 P28482 2/20 0.52
BCL2A1 Q16548 2/20 0.52
HSD17B10 Q99714 2/20 0.52
TLR9 Q9NR96 2/20 0.52
RECQL P46063 1/20 0.52
RAB9A P51151 1/20 0.52
CYP3A4 P08684 2/20 0.49
CYP2C19 P33261 2/20 0.49
HSD11B1 P28845 1/20 0.49
HTT P42858 2/20 0.48
ALOX15 P16050 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL1464292 0.83 KMT2A (0.68) GAAKMT2AHPGDNPSR1MAPT
SCHEMBL7509196 0.81 GAA (0.65) GAAKMT2AHPGDNPSR1MAPT
SCHEMBL28250457 0.81 MAPT (0.52) GAAHPGDNPSR1MAPTRECQL
SCHEMBL6456959 0.80 RECQL (0.59) GAAKMT2AHPGDNPSR1RECQL
SCHEMBL8385129 0.79 CA1 (0.57) GAANPSR1MAPTRECQLCYP3A4
SCHEMBL13299628 0.79 GAA (0.62) GAAKMT2AHPGDNPSR1MAPT
SCHEMBL7424942 0.79 GAA (0.62) GAAKMT2AHPGDNPSR1MAPT
SCHEMBL3915805 0.79 GAA (0.62) GAAKMT2AHPGDNPSR1MAPT
SCHEMBL17189666 0.79 RECQL (0.61) GAAKMT2AHPGDNPSR1RECQL
SCHEMBL11224693 0.78 GAA (0.64) GAAKMT2AHPGDNPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101475528-A Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO LTD (JP) 2009-07-08 CN disclosed
CN-100451004-C Pyrimidine derivatives ARENA PHARM INC (JP) 2009-01-14 CN disclosed
CN-1798736-A Novel quinoline, tetrahydroquinazoline and pyrimidine derivatives and methods of treatment related to their use ARENA PHARM INC (JP) 2006-07-05 CN disclosed
US-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof TAISHO PHARMACEUTICAL CO., LTD. 2005-09-08 US disclosed
WO-2004087669-A1 NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF TAISHO PHARMACEUTICAL CO. LTD. (JP) 2004-10-14 WO disclosed
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP 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 (1 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-20050197350-A1 Novel quinoline, tetrahydroquinazoline, and pyrimidine derivatives and methods of treatment related to the use thereof HCRTR2, MCHR1, MCHR2 GAA 484/4885KMT2A 693/4885HPGD 2310/4885

“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.