SCHEMBL17720645

SCHEMBL17720645

c1ccc(-c2ccc(-c3ccccc3N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3ccc4c(c3)oc3ccccc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 4/20 0.39
▸ PLA2G4A P47712 4/20 0.39
▸ AHR P35869 2/20 0.37
▸ PLA2G10 O15496 1/20 0.37
▸ MMP12 P39900 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ THRB P10828 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HCRTR1 O43613 1/20 0.33
▸ TNKS O95271 2/20 0.33
▸ NPC1 O15118 3/20 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
SCHEMBL17720662 1.00 PLA2G2A (0.39) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL17720620 0.98 PLA2G2A (0.38) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL17720612 0.97 PLA2G2A (0.39) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL17720602 0.97 PLA2G2A (0.39) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL17720613 0.96 PLA2G2A (0.39) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL19543751 0.96 AHR (0.40) PLA2G2APLA2G4AAHRMMP12MMP13
SCHEMBL17720598 0.96 AHR (0.40) PLA2G2APLA2G4AAHRMMP12MMP13
SCHEMBL24472582 0.95 ALOX5 (0.37) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL17720652 0.95 PLA2G2A (0.38) PLA2G2APLA2G4AAHRPLA2G10MMP12
SCHEMBL17720651 0.95 AHR (0.37) PLA2G2APLA2G4AAHRPLA2G10MMP12

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-9947875-B2 Amine derivatives, material for organic electroluminescent device and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-17 — — US disclosed
US-9947875-B2 Amine derivatives, material for organic electroluminescent device and organic electroluminescent device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-17 — — US disclosed
US-20160126467-A1 AMINE DERIVATIVES, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-05-05 — — US disclosed
US-20160126467-A1 AMINE DERIVATIVES, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-05-05 — — 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-20160126467-A1 AMINE DERIVATIVES, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME PNMT, ODC1, ALKBH1 PLA2G2A 3918/4885PLA2G4A 4375/4885AHR 1159/4885

“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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