SCHEMBL17451694

SCHEMBL17451694

c1ccc(-c2ccc3c(c2)c2c4c5ccccc5oc4c4ccccc4c2n3-c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.38
PLA2G4A P47712 4/20 0.38
ALDH1A1 P00352 3/20 0.37
POLB P06746 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.37
BRCA1 P38398 1/20 0.37
PPARG P37231 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NR2E3 Q9Y5X4 1/20 0.36
NCOR2 Q9Y618 1/20 0.36
KDM4E B2RXH2 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ATM Q13315 1/20 0.34
LMNA P02545 2/20 0.34
PLA2G10 O15496 1/20 0.34
CA12 O43570 1/20 0.33
CA9 Q16790 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
SCHEMBL17451695 0.95 PLA2G2A (0.38) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL17451685 0.92 ALDH1A1 (0.39) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL17990672 0.89 ALDH1A1 (0.38) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL17451715 0.89 KDM4E (0.37) ALDH1A1POLBMEN1KMT2AHSD17B10
SCHEMBL18619198 0.87 PLA2G2A (0.36) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL17405199 0.86 ALDH1A1 (0.39) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL17451675 0.86 KDM4E (0.44) ALDH1A1POLBMEN1KMT2AHSD17B10
SCHEMBL17451691 0.85 L3MBTL1 (0.46) ALDH1A1POLBMEN1KMT2AHSD17B10
SCHEMBL17990604 0.85 MEN1 (0.36) PLA2G2APLA2G4AALDH1A1POLBMEN1
SCHEMBL19830370 0.85 KDM4E (0.41) PLA2G2APLA2G4AALDH1A1POLBMEN1

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-9799835-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2017-10-24 US disclosed
US-9799835-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2017-10-24 US disclosed
US-20160020410-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-21 US disclosed
US-20160020410-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-21 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-20160020410-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF OR51E2, NFE2L2, ORAI2 PLA2G2A 3809/4885PLA2G4A 3453/4885ALDH1A1 1349/4885

“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.