SCHEMBL17212583

SCHEMBL17212583

Brc1ccc2ccc(-c3ccc(-c4cccc5c4oc4ccccc45)nc3)cc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
EGFR P00533 1/20 0.35
BIRC5 O15392 1/20 0.34
TNKS O95271 1/20 0.34
PRKDC P78527 3/20 0.34
GRM4 Q14833 2/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
PIM1 P11309 3/20 0.33
CSNK2A2 P19784 3/20 0.33
CSNK2B P67870 3/20 0.33
PIM3 Q86V86 3/20 0.33
PIM2 Q9P1W9 3/20 0.33
GGPS1 O95749 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33

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
SCHEMBL17212576 0.93 ALOX5 (0.48) ALOX5CYP11B1CYP11B2PRKDCGRM4
SCHEMBL17212568 0.90 ALOX5 (0.49) ALOX5CYP11B1CYP11B2PRKDCGRM4
SCHEMBL17212707 0.88 ALOX5 (0.43) ALOX5PRKDCGRM4PIK3CDPIK3CB
SCHEMBL17212608 0.88 ALOX5 (0.43) ALOX5CYP11B1CYP11B2EGFRBIRC5
SCHEMBL26548766 0.87 ALOX5 (0.43) ALOX5TNKSPRKDCPIK3CDPIK3CB
SCHEMBL26555157 0.87 ALOX5 (0.43) ALOX5PRKDCGRM4PIK3CDPIK3CB
SCHEMBL26555137 0.87 ALOX5 (0.43) ALOX5PRKDCGRM4PIK3CDPIK3CB
SCHEMBL26548776 0.86 ALOX5 (0.42) ALOX5PRKDCGRM4PIK3CDPIK3CB
SCHEMBL17212563 0.84 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL26555166 0.84 ALOX5 (0.40) ALOX5PRKDCPIK3CDPIK3CBGGPS1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2937347-B1 NOVEL COMPOUND AND ORGANIC ELECTRONIC ELEMENT USING SAME LG CHEMICAL LTD (KR) 2019-01-02 EP disclosed
US-9614161-B2 Compound and organic electronic element using same LG CHEM, LTD. (KR) 2017-04-04 US disclosed
US-9614161-B2 Compound and organic electronic element using same LG CHEM, LTD. (KR) 2017-04-04 US disclosed
US-20150340620-A1 NOVEL COMPOUND AND ORGANIC ELECTRONIC ELEMENT USING SAME LG CHEM, LTD. (KR) 2015-11-26 US disclosed
US-20150340620-A1 NOVEL COMPOUND AND ORGANIC ELECTRONIC ELEMENT USING SAME LG CHEM, LTD. (KR) 2015-11-26 US disclosed
EP-2937347-A1 NOVEL COMPOUND AND ORGANIC ELECTRONIC ELEMENT USING SAME LG Chem, Ltd. (KR) 2015-10-28 EP 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-20150340620-A1 NOVEL COMPOUND AND ORGANIC ELECTRONIC ELEMENT USING SAME ESR1, EML4, OR51E2 ALOX5 2392/4885CYP11B1 2741/4885CYP11B2 1836/4885

“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.