SCHEMBL9944205

SCHEMBL9944205

CC(=O)c1ccc(NC(=O)c2cc(C)c(OC(C)C)c(Cl)c2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 3/20 0.47
RORC P51449 1/20 0.45
TAS1R3 Q7RTX0 3/20 0.44
TAS1R1 Q7RTX1 3/20 0.44
TAS1R2 Q8TE23 3/20 0.44
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KCNQ3 O43525 1/20 0.42
KCNQ2 O43526 1/20 0.42
MAPT P10636 1/20 0.40
TP53 P04637 1/20 0.40
MET P08581 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 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
SCHEMBL9944097 0.92 PLAU (0.47) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944173 0.90 RORC (0.48) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944230 0.89 RORC (0.48) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944203 0.89 TAS1R3 (0.55) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL9944210 0.87 PLAU (0.47) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944204 0.86 RAB9A (0.54) PLAUTAS1R3TAS1R1TAS1R2NPC1
SCHEMBL9944164 0.85 PLAU (0.49) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944179 0.85 TAS1R3 (0.52) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944217 0.85 TAS1R3 (0.51) PLAURORCTAS1R3TAS1R1TAS1R2
SCHEMBL9944084 0.84 RAB9A (0.51) PLAURORCTAS1R3TAS1R1TAS1R2

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-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use KING'S COLLEGE LONDON (GB) 2012-06-14 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-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use RARA, RARB, RARG PLAU 4014/4885RORC 10/4885TAS1R3 1123/4885

“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.