SCHEMBL18010669

SCHEMBL18010669

CC1(C)OB(c2ccc(-c3nc(-c4ccccc4)cc(-c4ccc(C#N)cc4)n3)cc2)OC1(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 5/20 0.55
▸ LPL P06858 4/20 0.55
▸ ABCG2 Q9UNQ0 8/20 0.49
▸ MYC P01106 1/20 0.44
▸ ABCB1 P08183 6/20 0.43
▸ DGAT1 O75907 1/20 0.43
▸ MAOA P21397 1/20 0.42
▸ MAOB P27338 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ NTSR1 P30989 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ GABRA3 P34903 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41

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
SCHEMBL23384077 0.92 LIPG (0.60) LIPGLPLABCG2ABCB1DGAT1
SCHEMBL31463120 0.91 LIPG (0.63) LIPGLPLABCG2ABCB1DGAT1
SCHEMBL29730356 0.90 LIPG (0.68) LIPGLPLDGAT1MAOAMAOB
SCHEMBL16716568 0.90 LIPG (0.68) LIPGLPLDGAT1MAOAMAOB
SCHEMBL13492088 0.90 LIPG (0.68) LIPGLPLDGAT1MAOAMAOB
SCHEMBL15783448 0.90 LIPG (0.68) LIPGLPLDGAT1MAOAMAOB
SCHEMBL23075584 0.88 LIPG (0.71) LIPGLPLDGAT1MAOAMAOB
SCHEMBL17996253 0.88 LIPG (0.71) LIPGLPLDGAT1MAOAMAOB
SCHEMBL24534334 0.88 LIPG (0.71) LIPGLPLDGAT1MAOAMAOB
SCHEMBL22320238 0.88 LIPG (0.71) LIPGLPLDGAT1MAOAMAOB

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-9954181-B2 Hetero-cyclic compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2018-04-24 — — US disclosed
US-20160233430-A1 HETERO-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME (As Amended) LG CHEM, LTD. (KR) 2016-08-11 — — 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-20160233430-A1 HETERO-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME (As Amended) CRY1, CRY2, PER2 LIPG 3265/4885LPL 2186/4885ABCG2 3949/4885

“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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