SCHEMBL15748866

SCHEMBL15748866

Cc1nn2c(C)c(C(=O)O)nnc2c1-c1cc(Cl)cc(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.57
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 1/20 0.39
THRB P10828 2/20 0.38
PKM P14618 1/20 0.38
GLA P06280 1/20 0.38
TP53 P04637 4/20 0.37
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL15748794 0.88 MAPT (0.72) MAPTTDP1L3MBTL1KDM4ETHRB
SCHEMBL17192439 0.88 MAPT (0.52) MAPTTDP1L3MBTL1KDM4ETHRB
SCHEMBL15748777 0.85 MAPT (0.56) MAPTTHRB
SCHEMBL17192453 0.84 MAPT (0.55) MAPTTDP1L3MBTL1KDM4ETHRB
SCHEMBL15748868 0.82 MAPT (0.53) MAPTTDP1L3MBTL1KDM4ETHRB
SCHEMBL15748867 0.82 MAPT (0.52) MAPTKDM4ETHRBGLATP53
SCHEMBL15748853 0.80 MAPT (0.53) MAPTTHRBTP53ALDH1A1
SCHEMBL15748869 0.78 MAPT (0.54) MAPTKDM4ETHRBTP53MEN1
SCHEMBL15748793 0.78 MAPT (0.59) MAPTTHRBTP53
SCHEMBL15748789 0.76 MAPT (0.58) MAPTTDP1L3MBTL1KDM4ETHRB

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 4258/4885TDP1 3098/4885L3MBTL1 1373/4885

“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.