SCHEMBL17358248

SCHEMBL17358248

Cc1cc(OCc2ccccc2)c2c(c1)O[C@H](c1ccc(OCc3ccccc3)c(C)c1)[C@@H](OCc1ccccc1)[C@H]2O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 5/20 0.40
▸ MRGPRX4 Q96LA9 5/20 0.37
▸ FFAR1 O14842 3/20 0.35
▸ CETP P11597 1/20 0.34
▸ MAPT P10636 2/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ AKR1B1 P15121 1/20 0.34
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ DHODH Q02127 1/20 0.33
▸ MAOB P27338 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
SCHEMBL17358232 0.93 APP (0.37) FFAR4CETPMAPTCYP2C9CYP2C19
SCHEMBL18427307 0.81 PIN1 (0.38) MAPTL3MBTL1MAOB
SCHEMBL5268318 0.81 PIN1 (0.38) MAPTL3MBTL1MAOB
SCHEMBL5265501 0.81 PIN1 (0.38) MAPTL3MBTL1MAOB
SCHEMBL17523255 0.80 MRGPRX4 (0.43) MRGPRX4FFAR1
SCHEMBL17358249 0.78 CYP3A4 (0.43) FFAR4MRGPRX4FFAR1MAPTSMN1; SMN2
SCHEMBL5523109 0.78 SIRT1 (0.41) MAPTCYP2C19L3MBTL1MAOB
SCHEMBL5620552 0.78 SIRT1 (0.41) MAPTCYP2C19L3MBTL1MAOB
SCHEMBL3932082 0.71 STING1 (0.41) SMN1; SMN2MAOB
SCHEMBL15450266 0.71 CYP3A4 (0.44) MAPTSMN1; SMN2TDP1

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-20150368223-A1 NOVEL APPROACH FOR SYNTHESIS OF CATECHINS EPIRIUM BIO INC. 2015-12-24 — — 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-20150368223-A1 NOVEL APPROACH FOR SYNTHESIS OF CATECHINS NQO1, COMT, NNMT FFAR4 1730/4885MRGPRX4 4774/4885FFAR1 2075/4885

“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.

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