SCHEMBL22222467

SCHEMBL22222467

COc1cc(C)c(C(C)C)nc1C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
GFER P55789 1/20 0.42
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.40
PRNP P04156 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
SMPD3 Q9NY59 1/20 0.37
P2RX3 P56373 1/20 0.37
P2RX2 Q9UBL9 1/20 0.37
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
CRHR1 P34998 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL20780491 0.86 POLB (0.43) POLBGAAGFERALDH1A1MAPT
SCHEMBL15928286 0.81 ALDH1A1 (0.38) POLBGAAGFERALDH1A1MAPT
SCHEMBL13547519 0.78 MAPK1 (0.38) POLBGAAGFERALDH1A1MAPT
SCHEMBL13547491 0.78 POLB (0.38) POLBGAAGFERALDH1A1MAPT
SCHEMBL9846198 0.76 MAPT (0.46) POLBALDH1A1MAPTPRNPNPSR1
SCHEMBL13362540 0.76 NOS3 (0.31)
SCHEMBL26551445 0.73 POLB (0.47) POLBGAAGFERSMPD3P2RX3
SCHEMBL16722921 0.73 NOS3 (0.34) LMNA
SCHEMBL20285938 0.71 GLP1R (0.37) LMNA
SCHEMBL25647559 0.71 ALDH1A1 (0.42) POLBGAAGFERALDH1A1MAPT

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-20200222406-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., STOCKPORT ZUG BRANCH (CH) 2020-07-16 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-20200222406-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS HMGCR, PCSK9, FABP3 POLB 3763/4885GAA 962/4885GFER 2596/4885

“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.