SCHEMBL17299437

SCHEMBL17299437

c1ccc(-c2ccc3oc4c(ccc5ccc6c7cc(-c8ccccc8)ccc7sc6c54)c3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.41
▸ PGR P06401 1/20 0.37
▸ PLA2G2A P14555 3/20 0.36
▸ PLA2G4A P47712 3/20 0.36
▸ PIM3 Q86V86 3/20 0.35
▸ PIM1 P11309 2/20 0.35
▸ PIM2 Q9P1W9 2/20 0.35
▸ CSNK2A2 P19784 1/20 0.35
▸ CSNK2B P67870 1/20 0.35
▸ ESR2 Q92731 2/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ F9 P00740 2/20 0.34
▸ GAA P10253 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ TBK1 Q9UHD2 1/20 0.32
▸ PRKDC P78527 2/20 0.32
▸ PLA2G10 O15496 1/20 0.32
▸ PTPRF P10586 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
SCHEMBL24341015 0.90 LIMK1 (0.36) LIMK1PGRPLA2G2APLA2G4APIM3
SCHEMBL24341021 0.88 LIMK1 (0.34) LIMK1PGRPLA2G2APLA2G4APIM3
SCHEMBL1636254 0.87 LIMK1 (0.45) LIMK1PGRPLA2G2APLA2G4APIM3
SCHEMBL24341308 0.86 ESR2 (0.36) LIMK1PLA2G2APLA2G4AESR2ESR1
SCHEMBL19108800 0.86 ALOX5 (0.41) LIMK1PIM3PIM1PIM2CSNK2A2
SCHEMBL9889883 0.85 LIMK1 (0.46) LIMK1PGRPLA2G2APLA2G4APIM3
SCHEMBL24342069 0.85 ESR2 (0.33) LIMK1PLA2G2APLA2G4AESR2ESR1
SCHEMBL9889893 0.84 LIMK1 (0.45) LIMK1PGRPLA2G2APLA2G4APIM3
SCHEMBL20390240 0.84 LIMK1 (0.38) LIMK1PLA2G2APLA2G4APIM3PIM1
SCHEMBL1636884 0.84 LIMK1 (0.49) LIMK1PGRPLA2G2APLA2G4APIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10003031-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-06-19 — — US disclosed
US-10003031-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2018-06-19 — — US disclosed
US-20150349276-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2015-12-03 — — US disclosed
US-20150349276-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2015-12-03 — — 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 (2 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-20150349276-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF ORAI2, ESR1, OR10J3 LIMK1 599/4885PGR 3356/4885PLA2G2A 3834/4885
US-10003031-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof ORAI2, ESR1, OR10J3 LIMK1 599/4885PGR 3356/4885PLA2G2A 3834/4885

“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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