SCHEMBL1749967

SCHEMBL1749967

Cc1cc(N2CCC(CNC(=O)O)C2)ccc1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 16/20 0.49
MAPK1 P28482 11/20 0.49
ALDH1A1 P00352 10/20 0.49
ALOX15 P16050 2/20 0.49
TDP1 Q9NUW8 10/20 0.47
KDM4E B2RXH2 5/20 0.47
MCL1 Q07820 3/20 0.47
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.46
USP2 O75604 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
GFER P55789 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GAA P10253 6/20 0.45
ATM Q13315 2/20 0.45

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
SCHEMBL1749531 0.89 MAPT (0.44) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL1749371 0.87 MAPT (0.44) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL1749373 0.87 MAPT (0.44) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL1749591 0.84 NOTUM (0.48) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL6792106 0.84 MAPT (0.42) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL1749697 0.83 MAPT (0.52) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL1749694 0.83 MAPT (0.52) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL1537908 0.82 GAA (0.51) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL20508146 0.80 USP30 (0.47) MAPTMAPK1ALDH1A1ALOX15TDP1
SCHEMBL14905666 0.79 EPHX2 (0.61) MAPTMAPK1ALDH1A1ALOX15TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-11-04 US 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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 MAPT 4824/4885MAPK1 496/4885ALDH1A1 286/4885

“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.