SCHEMBL21115380

SCHEMBL21115380

N#Cc1ccc2oc3ccccc3c2c1-c1ccc(Cl)c2c1oc1cc3ccccc3cc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ ADORA2A P29274 1/20 0.35
▸ AHR P35869 5/20 0.35
▸ PIM1 P11309 1/20 0.32
▸ CSNK2A2 P19784 1/20 0.32
▸ CSNK2B P67870 1/20 0.32
▸ PIM3 Q86V86 1/20 0.32
▸ PIM2 Q9P1W9 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ ALPI P09923 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ CASP7 P55210 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
SCHEMBL21115377 0.81 TTR (0.39) KDM4EALDH1A1AHRMEN1CYP3A4
SCHEMBL23285615 0.79 AHR (0.41) KDM4EALDH1A1AHRPIM1CSNK2A2
SCHEMBL23285554 0.76 ALOX5 (0.50) KDM4EALDH1A1AHRPIM1CSNK2A2
SCHEMBL21115453 0.75 CDC14B (0.33) KDM4EADORA2AAHRPIM1CSNK2A2
SCHEMBL21115447 0.75 ALOX5 (0.43) KDM4EALDH1A1ADORA2AMEN1MAPT
SCHEMBL28539265 0.75 AHR (0.43) KDM4EADORA2AAHRPIM1CSNK2A2
SCHEMBL21115379 0.75 AHR (0.37) KDM4EALDH1A1AHRPIM1CSNK2A2
SCHEMBL23168609 0.74 AHR (0.41) KDM4EALDH1A1ADORA2AAHRPIM1
SCHEMBL23285631 0.73 AHR (0.39) KDM4EALDH1A1AHRMEN1CYP3A4
SCHEMBL19880222 0.72 SLC22A12 (0.38) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190198769-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2019-06-27 — — 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-20190198769-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ODC1, ETV6 KDM4E 961/4885ALDH1A1 228/4885ADORA2A 4367/4885

“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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