SCHEMBL18820528

SCHEMBL18820528

c1ccc2c(c1)-c1cccc3c(-c4cccc5sc6ccc(-c7ccc8c9ccccc9c9ccccc9c8c7)cc6c45)ccc-2c13

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
GPR3 P46089 1/20 0.36
HPGD P15428 3/20 0.36
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
BRDT Q58F21 1/20 0.35
MAPT P10636 5/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL18820576 0.89 MAPT (0.40) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL18820533 0.88 CRHBP (0.39) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL18819959 0.88 ALDH1A1 (0.40) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL18820514 0.87 ALDH1A1 (0.49) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL18820610 0.86 ALDH1A1 (0.41) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL18820534 0.86 ALOX5 (0.49) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL17229085 0.85 ALOX5 (0.43) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL21036056 0.84 ALOX5 (0.40) ALOX5GPR3HPGDALDH1A1L3MBTL1
SCHEMBL17692265 0.84 ALOX5 (0.46) ALOX5CRHBPCRHR2KEAP1NFE2L2
SCHEMBL21035294 0.82 ALOX5 (0.41) ALOX5GPR3HPGDALDH1A1L3MBTL1

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
EP-3368520-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-04-26 EP disclosed
US-11355714-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2022-06-07 US disclosed
US-20190058133-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-02-21 US disclosed
WO-2017071791-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-05-04 WO 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-11355714-B2 Materials for organic electroluminescent devices SLCO4C1, SLCO2A1, SLCO2B1 ALOX5 1495/4885CRHBP 3074/4885CRHR2 4459/4885
US-20190058133-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO4C1, SLCO2A1, SLCO2B1 ALOX5 1495/4885CRHBP 3074/4885CRHR2 4459/4885

“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.