SCHEMBL4564004

SCHEMBL4564004

CCOC(=O)C(Cc1cccc(OC(F)(F)F)c1)C(C)=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
TSHR P16473 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MMP8 P22894 1/20 0.44
CETP P11597 2/20 0.43
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
CNR1 P21554 1/20 0.42
MAPK14 Q16539 1/20 0.42
KCNB1 Q14721 1/20 0.42
EPHX1 P07099 1/20 0.42
CYP2C9 P11712 1/20 0.41
VNN1 O95497 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41

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
SCHEMBL26985826 0.86 EPHX1 (0.47) MAPK1L3MBTL1TSHRTDP1CETP
SCHEMBL26995232 0.86 EPHX1 (0.47) MAPK1L3MBTL1TSHRTDP1CETP
SCHEMBL15262042 0.85 MAPK1 (0.47) MAPK1L3MBTL1TSHRTDP1MMP8
SCHEMBL2425450 0.84 ALDH1A1 (0.56) MAPK1L3MBTL1TSHRTDP1MMP8
SCHEMBL5753584 0.84 MDM2 (0.49) MAPK1L3MBTL1TSHRTDP1MMP8
SCHEMBL4436742 0.82 HTR2A (0.51) MAPK1L3MBTL1TSHRTDP1MMP8
SCHEMBL25408416 0.80 MMP8 (0.49) MAPK1L3MBTL1TSHRTDP1MMP8
SCHEMBL2429158 0.80 ALDH1A1 (0.59) MAPK1L3MBTL1TSHRTDP1MMP8
SCHEMBL4439036 0.79 EPHX2 (0.40) TSHRMMP8PPARGPPARAALDH1A1
SCHEMBL26616861 0.79 EPHX1 (0.55) CETPCHRM2CHRM1CHRM3CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101801972-A Pyrazolo [1,5-A]pyrimidines as inhibitors of stearoyl-coA desaturase INOVACIA AB 2010-08-11 CN disclosed
EP-2137187-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE Inovacia AB (SE) 2009-12-30 EP disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
US-20080255153-A1 New compounds BIOVITRUM AB (PUBL) (SE) 2008-10-16 US disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 WO disclosed
WO-2008116898-A1 PYRAZOLO [1,5-A]PYRIMIDINES AS INHIBITORS OF STEAROYL-COA DESATURASE BIOVITRUM AB (PUBL) (SE) 2008-10-02 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 (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-20080255153-A1 New compounds SCD, SCD5, FADS2 MAPK1 1308/4885L3MBTL1 4241/4885TSHR 4591/4885

“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.