SCHEMBL24065373

SCHEMBL24065373

COC(=O)c1ncc(C(=O)NCc2ccc(F)c(Cl)c2)c2c1OC(C)(C)OC2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.41
POLB P06746 1/20 0.40
PDE5A O76074 6/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
ROCK2 O75116 1/20 0.38
TP53 P04637 1/20 0.38
HSP90AA1 P07900 2/20 0.38
HSP90AB1 P08238 2/20 0.38
CNR2 P34972 1/20 0.38
PPARG P37231 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
WDR5 P61964 1/20 0.37

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
SCHEMBL12444456 0.87 MAPT (0.47) MAPK1TP53HSP90AA1HSP90AB1LMNA
SCHEMBL2146871 0.83 MAPT (0.38) LMNAHPGD
SCHEMBL1503297 0.79 MAPT (0.43) MAPK1PDE5ATP53LMNAHPGD
SCHEMBL1503147 0.78 ALDH1A1 (0.39) MAPK1PPARG
SCHEMBL24065242 0.78 HDAC1 (0.47) MAPK1HDAC3HDAC1HDAC2HDAC6
SCHEMBL2147119 0.77 ALDH1A1 (0.36) MAPK1LMNA
SCHEMBL13577658 0.75 MAOB (0.38) MAPK1
SCHEMBL1503145 0.74 MAOB (0.37) MAPK1
SCHEMBL12444469 0.73 POLB (0.40) POLBHDAC3HDAC6ROCK2CNR2
SCHEMBL12444452 0.72 HDAC3 (0.36) HDAC3HDAC1HDAC2HDAC6

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-20210369688-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL MONTREAL HEART INSTITUTE (CA) 2021-12-02 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-20210369688-A1 METHODS OF TREATING ELEVATED PLASMA CHOLESTEROL CETP, LDLR, APOB MAPK1 2839/4885POLB 4581/4885PDE5A 1186/4885

“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.