SCHEMBL17359643

SCHEMBL17359643

CCCCOc1cc(OCCCC)c2c(c1)O[C@H](c1ccc(OCCCC)c(OCCCC)c1)C(OCCCC)C2

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ F10 P00742 3/20 0.43
▸ MEN1 O00255 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ABCB1 P08183 12/20 0.39
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38

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
SCHEMBL17359682 1.00 CYP3A4 (0.45) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL15918823 1.00 CYP3A4 (0.45) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL5133861 0.97 CYP3A4 (0.45) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL14701472 0.92 CYP3A4 (0.45) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL14701450 0.87 ALDH1A1 (0.63) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL13508825 0.86 ALDH1A1 (0.52) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL13077184 0.86 CYP3A4 (0.56) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL8240944 0.86 CYP3A4 (0.56) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL8249233 0.86 CYP3A4 (0.56) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10
SCHEMBL13508834 0.86 CYP3A4 (0.56) CYP3A4MAPK1ALDH1A1SMN1; SMN2F10

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-9556140-B2 Approach for synthesis of catechins SPHAERA PHARMA PVT. LTD. (IN) 2017-01-31 — — US disclosed
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 CYP3A4 144/4885MAPK1 2894/4885ALDH1A1 1326/4885

“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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