SCHEMBL19501997

SCHEMBL19501997

CC1(C)OB(c2ccc3oc4cccc(-c5nc(-c6ccccc6)c6ccccc6n5)c4c3c2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 5/20 0.39
▸ LPL P06858 4/20 0.39
▸ EGFR P00533 2/20 0.39
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ NUDT1 P36639 3/20 0.34
▸ WHR1 P49842 1/20 0.34
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ IDO1 P14902 1/20 0.33
▸ TDO2 P48775 1/20 0.33
▸ ADORA2A P29274 2/20 0.32
▸ IRAK4 Q9NWZ3 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ NR1I3 Q14994 2/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ VDR P11473 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31

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
SCHEMBL19502159 0.92 LIPG (0.39) LIPGLPLEGFRMEN1KMT2A
SCHEMBL19502155 0.90 LPL (0.37) LIPGLPLEGFRMEN1KMT2A
SCHEMBL22195877 0.89 LPL (0.38) LIPGLPLEGFRMEN1KMT2A
SCHEMBL29637773 0.88 LIPG (0.44) LIPGLPLEGFRMEN1KMT2A
SCHEMBL19501987 0.88 LIPG (0.44) LIPGLPLEGFRMEN1KMT2A
SCHEMBL19502384 0.88 LIPG (0.39) LIPGLPLEGFRMEN1KMT2A
SCHEMBL19502230 0.87 LIPG (0.43) LIPGLPLEGFRMEN1KMT2A
SCHEMBL20983882 0.86 LIPG (0.48) LIPGLPLEGFRPRMT5WDR77
SCHEMBL21999344 0.86 LIPG (0.45) LIPGLPLEGFRPRMT5WDR77
SCHEMBL38266197 0.86 LIPG (0.48) LIPGLPLEGFRPRMT5WDR77

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-20190165282-A1 HETEROCYCLIC COMPOUNDS COMPRISING DIBENZOFURAN AND/OR DIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2019-05-30 — — US disclosed
WO-2017178311-A1 HETEROCYCLIC COMPOUNDS COMPRISING DIBENZOFURAN AND/OR DIBENZOTHIOPHENE STRUCTURES MERCK PATENT GMBH (DE) 2017-10-19 — — WO 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-20190165282-A1 HETEROCYCLIC COMPOUNDS COMPRISING DIBENZOFURAN AND/OR DIBENZOTHIOPHENE STRUCTURES DDT, NUDT1, ETFB LIPG 4625/4885LPL 4781/4885EGFR 2418/4885

“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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