SCHEMBL20870643

SCHEMBL20870643

CC1(C)OB(c2cc(C#N)cc(-c3cccc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)c3)c2)OC1(C)C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 9/20 0.53
▸ LPL P06858 8/20 0.53
▸ PGR P06401 8/20 0.37
▸ GABRA1 P14867 1/20 0.35
▸ GABRG2 P18507 1/20 0.35
▸ GABRB3 P28472 1/20 0.35
▸ GABRA5 P31644 1/20 0.35
▸ GABRA3 P34903 1/20 0.35
▸ ESR2 Q92731 1/20 0.34
▸ AR P10275 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34

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
SCHEMBL21628353 0.96 LIPG (0.57) LIPGLPLPGRESR2CYP19A1
SCHEMBL23020133 0.92 LIPG (0.44) LIPGLPLPGRGABRA1GABRG2
SCHEMBL31625405 0.89 LIPG (0.59) LIPGLPLGABRA1GABRG2GABRB3
SCHEMBL24443047 0.88 LIPG (0.43) LIPGLPLPGRGABRA1GABRG2
SCHEMBL20088886 0.87 LIPG (0.68) LIPGLPL
SCHEMBL20088879 0.87 LIPG (0.68) LIPGLPL
SCHEMBL20088874 0.87 LIPG (0.68) LIPGLPL
SCHEMBL17702117 0.87 LIPG (0.68) LIPGLPL
SCHEMBL18134363 0.87 LIPG (0.68) LIPGLPL
SCHEMBL30025201 0.87 LIPG (0.68) LIPGLPL

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
WO-2019066340-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2019-04-04 — — WO disclosed
US-20160122405-A1 HOMEODOMAIN FUSION PROTEINS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-05-05 — — 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-20160122405-A1 HOMEODOMAIN FUSION PROTEINS AND USES THEREOF ZFX, CNBP, CDYL LIPG 3494/4885LPL 2962/4885PGR 3487/4885

“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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