SCHEMBL15748868

SCHEMBL15748868

Cc1nn2c(C)c(C(=O)O)nnc2c1-c1ccc(F)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.53
THRB P10828 2/20 0.40
KDM4E B2RXH2 3/20 0.39
LMNA P02545 1/20 0.39
ADORA1 P30542 1/20 0.38
TP53 P04637 1/20 0.37
GLA P06280 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
ATM Q13315 1/20 0.37
DHODH Q02127 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL15748867 0.85 MAPT (0.52) MAPTTHRBKDM4EADORA1TP53
SCHEMBL15748794 0.84 MAPT (0.72) MAPTTHRBKDM4ETP53GLA
SCHEMBL15748777 0.83 MAPT (0.56) MAPTTHRB
SCHEMBL15748804 0.82 MAPT (0.57) MAPTTHRBKDM4ELMNATP53
SCHEMBL15748866 0.82 MAPT (0.57) MAPTTHRBKDM4ETP53GLA
SCHEMBL15748792 0.79 MAPT (0.47) MAPTTHRBKDM4ELMNAADORA1
SCHEMBL15748791 0.79 ALDH1A1 (0.48) MAPTKDM4ELMNAADORA1TP53
SCHEMBL15748801 0.76 MAPT (0.62) MAPTTHRBKDM4ETP53TDP1
SCHEMBL15748823 0.76 MAPT (0.54) MAPTTHRBLMNATP53GLA
SCHEMBL15748959 0.76 MAPT (0.54) MAPTTHRBKDM4ELMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676779-B2 Small molecule CFTR correctors DISCOVERYBIOMED, INC. (US) 2017-06-13 US disclosed
US-9676779-B2 Small molecule CFTR correctors DISCOVERYBIOMED, INC. (US) 2017-06-13 US disclosed
US-20150299206-A1 SMALL MOLECULE CFTR CORRECTORS DISCOVERYBIOMED, INC. (US) 2015-10-22 US disclosed
US-20150299206-A1 SMALL MOLECULE CFTR CORRECTORS DISCOVERYBIOMED, INC. (US) 2015-10-22 US disclosed
WO-2014081820-A1 SMALL MOLECULE CFTR CORRECTORS DISCOVERYBIOMED, INC. (US) 2014-05-30 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-20150299206-A1 SMALL MOLECULE CFTR CORRECTORS CFTR, CLCN2, SLC26A4 MAPT 4258/4885THRB 2036/4885KDM4E 4245/4885

“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.