SCHEMBL994604

SCHEMBL994604

CCC1(c2ccc3c(c2)OCO3)NC(=O)N(CCCCCOc2c(Cc3ccccc3)cnc3c(C(F)(F)F)cccc23)C1=O

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 16/20 0.56
NR1H3 Q13133 9/20 0.56
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
SCN9A Q15858 2/20 0.38

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
SCHEMBL994742 1.00 NR1H2 (0.56) NR1H2NR1H3MAPTL3MBTL1SCN9A
SCHEMBL994412 0.99 NR1H2 (0.56) NR1H2NR1H3MAPTL3MBTL1SCN9A
SCHEMBL994793 0.97 NR1H2 (0.52) NR1H2NR1H3MAPT
SCHEMBL995055 0.97 NR1H2 (0.52) NR1H2NR1H3MAPT
SCHEMBL994778 0.96 NR1H2 (0.52) NR1H2NR1H3MAPT
SCHEMBL997425 0.92 NR1H2 (0.60) NR1H2NR1H3MAPTL3MBTL1
SCHEMBL995440 0.92 NR1H2 (0.60) NR1H2NR1H3MAPTL3MBTL1
SCHEMBL12392089 0.92 NR1H2 (0.53) NR1H2NR1H3MAPTSCN9A
SCHEMBL12392143 0.92 NR1H2 (0.53) NR1H2NR1H3MAPTSCN9A
SCHEMBL995268 0.91 NR1H2 (0.60) NR1H2NR1H3MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008306-B2 Quinoline compounds KOWA COMPANY, LTD. (JP) 2011-08-30 US disclosed
EP-2272843-A1 QUINOLINE COMPOUND Kowa Company, Ltd. (JP) 2011-01-12 EP disclosed
EP-2272843-A1 QUINOLINE COMPOUND Kowa Company, Ltd. (JP) 2011-01-12 EP disclosed
US-20100016327-A1 QUINOLINE COMPOUNDS KOWA COMPANY, LTD. (JP) 2010-01-21 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-20100016327-A1 QUINOLINE COMPOUNDS NR1H2, NR1H3, LDLR NR1H2 1/4885NR1H3 2/4885MAPT 804/4885

“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.