SCHEMBL4447715

SCHEMBL4447715

NC(=O)c1ccc(-c2cncc(F)c2)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 10/20 0.47
CYP11B1 P15538 5/20 0.43
MKNK1 Q9BUB5 4/20 0.42
MKNK2 Q9HBH9 4/20 0.42
GPR52 Q9Y2T5 1/20 0.40
MAP4K4 O95819 1/20 0.40
ABL1 P00519 2/20 0.39
PIK3CG P48736 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL4442113 0.84 PDK2 (0.45) MKNK1MKNK2GPR52ABL1
SCHEMBL4442762 0.81 MKNK1 (0.66) MKNK1MKNK2
SCHEMBL27261215 0.80 MKNK1 (0.63) CYP11B2CYP11B1MKNK1MKNK2GPR52
SCHEMBL4448921 0.80 CHUK (0.58) MKNK1MKNK2GPR52MAP4K4
SCHEMBL5105678 0.79 MAP4K4 (0.43) CYP11B2MKNK1MKNK2GPR52MAP4K4
SCHEMBL4443151 0.78 GPR52 (0.45) MKNK1MKNK2GPR52KDM4EALDH1A1
Hydrochloric Acid SCHEMBL4439147 0.78 CHUK (0.56) MKNK1MKNK2GPR52MAP4K4
SCHEMBL4447717 0.78 CYP11B2 (0.52) CYP11B2CYP11B1
SCHEMBL5101905 0.77 AAK1 (0.48) CYP11B2MKNK1MKNK2GPR52MAP4K4
SCHEMBL30131558 0.76 IKBKB (0.56) MKNK2GPR52MAP4K4KDM4EALDH1A1

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-20080167348-A1 NOVEL SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-07-10 US claimed
EP-2118062-A1 SULFONAMIDE DERIVATIVES AS CHYMASE INHIBITORS F. Hoffmann-Roche AG (CH) 2009-11-18 EP disclosed
WO-2008084004-A1 SULFONAMIDE DERIVATIVES AS CHYMASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2008-07-17 WO disclosed
US-20080167348-A1 NOVEL SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-07-10 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-20080167348-A1 NOVEL SULFONAMIDE DERIVATIVES CMA1, ARSA, TPSAB1 CYP11B2 2356/4885CYP11B1 2751/4885MKNK1 4139/4885

“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.