SCHEMBL23515212

SCHEMBL23515212

COc1ccc2ccccc2c1Cc1c(CO)ccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CETP P11597 1/20 0.52
MAPT P10636 1/20 0.50
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.47
HTT P42858 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
HIF1A Q16665 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL19766698 0.88 MAPT (0.62) CETPMAPTKMT2AMEN1POLB
SCHEMBL702988 0.85 MAPT (0.58) CETPMAPTKMT2AMEN1POLB
SCHEMBL29620186 0.85 MAPT (0.58) CETPMAPTKMT2AMEN1POLB
SCHEMBL30186214 0.85 HSD17B10 (0.61) MAPTCYP1A2CYP2C9CYP2C19HSD17B10
SCHEMBL29625706 0.83 CYP1A2 (0.71) CETPMAPTKMT2AMEN1CYP1A2
SCHEMBL23515386 0.83 CYP1A2 (0.71) CETPMAPTKMT2AMEN1CYP1A2
SCHEMBL29625680 0.82 MAPT (0.47) CETPMAPTKMT2AMEN1POLB
SCHEMBL24953211 0.82 MAPT (0.47) CETPMAPTKMT2AMEN1POLB
SCHEMBL24953242 0.81 CETP (0.71) CETPMAPTKMT2AMEN1POLB
SCHEMBL29625758 0.81 CETP (0.71) CETPMAPTKMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230015875-A1 Ion Channel Antagonists/Blockers and Uses Thereof SHANGHAI EAST HOSPITAL (CN) 2023-01-19 US disclosed
WO-2021114313-A1 ION CHANNEL ANTAGONISTS/BLOCKERS AND USES THEREOF SHANGHAI EAST HOSPITAL (CN) 2021-06-17 WO 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-20230015875-A1 Ion Channel Antagonists/Blockers and Uses Thereof CACNA1F, CACNA1S, CACNA1D CETP 1967/4885MAPT 2678/4885KMT2A 3777/4885

“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.