SCHEMBL22214718

SCHEMBL22214718

CC1(C)OB(c2cccc(-c3cc4ccccc4s3)c2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 8/20 0.50
▸ LPL P06858 7/20 0.50
▸ HSD17B1 P14061 1/20 0.50
▸ HSD17B2 P37059 1/20 0.50
▸ APP P05067 2/20 0.48
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ ESR1 P03372 2/20 0.40
▸ ESR2 Q92731 2/20 0.40
▸ ERN1 O75460 1/20 0.40
▸ SNCA P37840 1/20 0.39
▸ PDGFRB P09619 3/20 0.39
▸ KDR P35968 3/20 0.39
▸ HDAC2 Q92769 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
SCHEMBL29631781 0.92 LIPG (0.60) LIPGLPLHSD17B1HSD17B2APP
SCHEMBL15481254 0.92 LIPG (0.60) LIPGLPLHSD17B1HSD17B2APP
SCHEMBL20983994 0.81 LIPG (0.63) LIPGLPLHSD17B1HSD17B2APP
SCHEMBL12700861 0.81 LIPG (0.62) LIPGLPLHSD17B1HSD17B2SNCA
SCHEMBL21541874 0.81 LIPG (0.55) LIPGLPLHSD17B1HSD17B2APP
SCHEMBL20984001 0.81 LIPG (0.61) LIPGLPLAPPCA1CA2
SCHEMBL757554 0.78 PDGFRB (0.46) LIPGLPLHSD17B1HSD17B2APP
SCHEMBL806784 0.78 LIPG (0.60) LIPGLPLCA1CA2CA9
SCHEMBL18015333 0.77 KDM1A (0.48) LIPGLPLSNCAPDGFRBKDR
SCHEMBL2496185 0.77 RAB9A (0.53) APPSNCA

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-20200227650-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME DOOSAN CORPORATION (KR) 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-20200227650-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME OR10J3, ORAI2, OR51E2 LIPG 1355/4885LPL 745/4885HSD17B1 3065/4885

“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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