SCHEMBL15748849

SCHEMBL15748849

Cc1nn2c(C)c(C(=O)Oc3ccccc3)nnc2c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.56
MAP3K14 Q99558 7/20 0.45
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
THRB P10828 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.40
HSD17B10 Q99714 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL15748777 0.85 MAPT (0.56) MAPTMAP3K14THRB
SCHEMBL15748795 0.84 MAPT (0.78) MAPTMAP3K14THRBALDH1A1MAPK1
SCHEMBL15748813 0.83 MAPT (0.58) MAPTMAP3K14SLC6A2SLC6A3THRB
SCHEMBL15748846 0.83 MAPT (0.58) MAPTMAP3K14THRBLMNA
SCHEMBL17192447 0.83 MAPT (0.54) MAPTMAP3K14THRBLMNA
SCHEMBL15748811 0.82 MAPT (0.55) MAPTMAP3K14THRBALDH1A1
SCHEMBL17192436 0.81 MAPT (0.51) MAPTMAP3K14THRBALDH1A1TP53
SCHEMBL17192449 0.81 MAPT (0.54) MAPTMAP3K14THRBTP53LMNA
SCHEMBL15748814 0.81 MAPT (0.55) MAPTMAP3K14SLC6A3THRBLMNA
SCHEMBL15748810 0.80 MAPT (0.53) MAPTMAP3K14THRBLMNA

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 4258/4885MAP3K14 3729/4885SLC6A2 526/4885

“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.