SCHEMBL1124253

SCHEMBL1124253

CCOC(=O)c1cnc2c(C(F)(F)F)cccc2c1-c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 10/20 0.68
NR1H3 Q13133 9/20 0.68
USP2 O75604 1/20 0.62
TP53 P04637 1/20 0.62
MAPK1 P28482 1/20 0.62
RECQL P46063 1/20 0.62
HSD17B10 Q99714 1/20 0.62
MAPT P10636 1/20 0.56
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL1124932 0.89 NR1H2 (0.68) NR1H2NR1H3USP2TP53MAPK1
SCHEMBL1124699 0.88 NR1H2 (0.67) NR1H2NR1H3USP2TP53MAPK1
SCHEMBL4012072 0.86 NR1H2 (0.75) NR1H2NR1H3USP2TP53MAPK1
SCHEMBL1124262 0.84 NR1H2 (0.79) NR1H2NR1H3
SCHEMBL27673920 0.84 NR1H2 (0.88) NR1H2NR1H3
SCHEMBL4012657 0.84 NR1H2 (0.84) NR1H2NR1H3
SCHEMBL1125003 0.83 TP53 (0.64) NR1H2NR1H3USP2TP53MAPK1
SCHEMBL442163 0.82 KMT2A (0.65) NR1H2NR1H3USP2TP53MAPK1
SCHEMBL1124642 0.82 KMT2A (0.65) NR1H2NR1H3USP2TP53MAPK1
SCHEMBL1125732 0.81 NR1H2 (0.81) NR1H2NR1H3

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
EP-2284157-A1 Quinolines useful in treating cardiovascular disease Wyeth (US) 2011-02-16 EP disclosed
US-7576215-B2 Quinolines and pharmaceutical compositions thereof WYETH (US) 2009-08-18 US disclosed
EP-1692111-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE Wyeth, A Corporation of the State of Delaware (US) 2006-08-23 EP disclosed
WO-2005058834-A2 QUINOLINES USEFUL IN TREATING CARDIOVASCULAR DISEASE WYETH (US) 2005-06-30 WO disclosed
US-20050131014-A1 Quinolines useful in treating cardiovascular disease WYETH (US) 2005-06-16 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-20050131014-A1 Quinolines useful in treating cardiovascular disease NR1H2, NR1H3, SREBF1 NR1H2 1/4885NR1H3 2/4885USP2 2597/4885

“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.