SCHEMBL16785672

SCHEMBL16785672

COc1cc(C)cc(OC(=O)OC(C)(C)C)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.55
▸ KMT2A Q03164 4/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HTT P42858 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ ELANE P08246 1/20 0.39
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTR2C P28335 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ GABRA1 P14867 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
SCHEMBL16785677 0.90 ACHE (0.48) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785680 0.87 ELANE (0.39) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785682 0.83 CYP3A4 (0.38) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785667 0.81 ACHE (0.53) ACHEMAPTALDH1A1HTTLMNA
SCHEMBL16785665 0.81 ACHE (0.53) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785678 0.79 ELANE (0.38) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785679 0.79 CYP3A4 (0.38) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785681 0.79 ELANE (0.38) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL16785670 0.78 ELANE (0.41) KMT2AMEN1CYP3A4ELANEHPGD
SCHEMBL16785671 0.77 ELANE (0.42) MAPTALDH1A1HTTLMNAELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365513-B2 Fullerene derivative, and method of preparing the same RICOH COMPANY, LTD. (JP) 2016-06-14 — — US disclosed
US-9365513-B2 Fullerene derivative, and method of preparing the same RICOH COMPANY, LTD. (JP) 2016-06-14 — — US disclosed
US-20150158814-A1 FULLERENE DERIVATIVE, AND METHOD OF PREPARING THE SAME RICOH COMPANY, LTD. (JP) 2015-06-11 — — US disclosed
US-20150158814-A1 FULLERENE DERIVATIVE, AND METHOD OF PREPARING THE SAME RICOH COMPANY, LTD. (JP) 2015-06-11 — — 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-20150158814-A1 FULLERENE DERIVATIVE, AND METHOD OF PREPARING THE SAME NCL, PFDN2, NUP50 ACHE 2315/4885KMT2A 3512/4885MEN1 1152/4885

“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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