SCHEMBL6566067

SCHEMBL6566067

COC(=O)c1cc(N)ccc1OC(c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.46
ABL1 P00519 1/20 0.40
MRGPRX4 Q96LA9 2/20 0.39
UTS2R Q9UKP6 4/20 0.39
CNR2 P34972 1/20 0.39
GAA P10253 2/20 0.39
PPARG P37231 3/20 0.38
SLC6A9 P48067 1/20 0.38
LMNA P02545 2/20 0.37
KLRK1 P26718 1/20 0.37
MICA Q29983 1/20 0.37
RAET1L Q5VY80 1/20 0.37
MDM2 Q00987 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL6567804 0.94 CFTR (0.51) CFTRMRGPRX4GAA
SCHEMBL6565797 0.91 CFTR (0.42) CFTRABL1MRGPRX4GAAPPARG
SCHEMBL6564379 0.90 CFTR (0.47) CFTRMRGPRX4GAASLC6A9
SCHEMBL6564639 0.90 CFTR (0.47) CFTRMRGPRX4CNR2GAASLC6A9
SCHEMBL6564439 0.88 ALDH1A1 (0.43) ABL1GAAPPARG
SCHEMBL6567751 0.87 CFTR (0.42) CFTRMRGPRX4GAALMNATHRB
SCHEMBL6565805 0.86 ABL1 (0.44) CFTRABL1GAAPPARGLMNA
SCHEMBL6566526 0.85 CFTR (0.43) CFTRMRGPRX4GAALMNA
SCHEMBL6565695 0.83 KMT2A (0.43) CFTRSLC6A9LMNA
SCHEMBL6566099 0.83 CFTR (0.43) CFTRMRGPRX4GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 CFTR 865/4885ABL1 2094/4885MRGPRX4 287/4885

“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.