SCHEMBL6567167

SCHEMBL6567167

Cc1cc(Oc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.45
PTGES O14684 2/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
TTR P02766 1/20 0.45
PPOX P50336 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
LMNA P02545 3/20 0.44
POLB P06746 2/20 0.44
KIF11 P52732 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL30934663 0.87 MEN1 (0.47) MAPTSMN1; SMN2MEN1KMT2ATTR
SCHEMBL11173503 0.87 MEN1 (0.47) MAPTSMN1; SMN2MEN1KMT2ATTR
SCHEMBL6491051 0.85 MAPT (0.56) MAPTSMN1; SMN2PTGESMEN1KMT2A
SCHEMBL6499329 0.84 PTGES (0.48) MAPTSMN1; SMN2PTGESMEN1KMT2A
SCHEMBL4607970 0.84 MAPT (0.47) MAPTSMN1; SMN2PTGESMEN1KMT2A
SCHEMBL24155937 0.84 MAPT (0.42) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL11720610 0.83 HPGD (0.56) MAPTSMN1; SMN2MEN1KMT2ATTR
SCHEMBL31009354 0.82 PTGES (0.54) MAPTSMN1; SMN2PTGESMEN1KMT2A
SCHEMBL13548695 0.82 MAPT (0.52) MAPTSMN1; SMN2MEN1KMT2ATDP1
SCHEMBL31009462 0.82 LMNA (0.52) MAPTSMN1; SMN2PTGESMEN1KMT2A

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-20210403456-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF EPILEPSY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-12-30 US disclosed
EP-0765871-B1 Substituted Quinoline-2-carboxamides, their preparation and their use as prolyle-4-hydroxylase Inhibitors FIBROGEN INC (US) 2004-03-31 EP disclosed
US-5726305-A Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-10 US disclosed
US-5719164-A Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
EP-0765871-A1 Substituted Quinoline-2-carboxamides, their preparation and their use as prolyle-4-hydroxylase Inhibitors HOECHST AKTIENGESELLSCHAFT (DE) 1997-04-02 EP 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-20210403456-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF EPILEPSY SLC6A11, SCN1A, SCN1B MAPT 741/4885SMN1; SMN2 2806/4885PTGES 259/4885

“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.