SCHEMBL5526709

SCHEMBL5526709

CC(=O)c1cc(OCc2ccccc2)c(OCc2ccccc2)c(C(=O)NCc2ccc(F)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
LMNA P02545 2/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
SGMS2 Q8NHU3 1/20 0.49
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
HTT P42858 2/20 0.48
MAPK1 P28482 1/20 0.48
HDAC3 O15379 2/20 0.47
HDAC4 P56524 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC7 Q8WUI4 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC10 Q969S8 2/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC9 Q9UKV0 2/20 0.47
HDAC5 Q9UQL6 2/20 0.47

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
SCHEMBL5528074 0.93 MAPT (0.61) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL5749408 0.91 LMNA (0.57) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL6424689 0.88 LMNA (0.55) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL5520252 0.86 LMNA (0.54) MAPTLMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL6372444 0.86 LMNA (0.60) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL5530865 0.85 LMNA (0.59) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL5519164 0.84 LMNA (0.56) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL5519289 0.84 LMNA (0.58) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL6373350 0.82 LMNA (0.53) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2
SCHEMBL5519519 0.82 LMNA (0.58) MAPTLMNAL3MBTL1SGMS2SMN1; SMN2

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-20070155744-A1 N-benzyl-3,4-dihyroxypyridine-2-carboxamide and n-benzyl-2,3-dihydroxypyridine-4- carboxamide compounds useful as hiv integrase inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P, ANGELETTI S.P.A. (IT) 2007-07-05 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-20070155744-A1 N-benzyl-3,4-dihyroxypyridine-2-carboxamide and n-benzyl-2,3-dihydroxypyridine-4- carboxamide compounds useful as hiv integrase inhibitors DUT, NQO2, TYMP MAPT 3791/4885LMNA 2213/4885L3MBTL1 2326/4885

“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.