SCHEMBL22196018

SCHEMBL22196018

c1ccc(-c2nc(-c3ccc4oc5ccccc5c4c3)nc(-c3ccc4oc5c(-c6nc(-c7ccccc7)c7sc8ccccc8c7n6)cccc5c4c3)n2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.37
▸ MAPT P10636 9/20 0.37
▸ ALDH1A1 P00352 5/20 0.36
▸ POLB P06746 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36
▸ TSHR P16473 3/20 0.34
▸ LMNA P02545 5/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ GAA P10253 1/20 0.34
▸ USP2 O75604 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ PTPRF P10586 2/20 0.33
▸ PTPN2 P17706 2/20 0.33
▸ PTPN1 P18031 2/20 0.33
▸ PIM1 P11309 1/20 0.32

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
SCHEMBL22195990 1.00 ALOX5 (0.37) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22329632 0.98 MAPT (0.36) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22195711 0.97 PRKDC (0.35) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22195706 0.97 PRKDC (0.35) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22195991 0.97 PRKDC (0.35) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22195873 0.97 PRKDC (0.35) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22196120 0.97 MAPT (0.35) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22329631 0.97 MAPT (0.35) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22195504 0.96 ALOX5 (0.36) ALOX5MAPTALDH1A1POLBKDM4E
SCHEMBL22195725 0.96 ALOX5 (0.36) ALOX5MAPTALDH1A1POLBKDM4E

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-20210230182-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2021-07-29 — — US disclosed
WO-2020141949-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-07-09 — — 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-20210230182-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, CYP1A1 ALOX5 629/4885MAPT 660/4885ALDH1A1 21/4885

“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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