SCHEMBL21349942

SCHEMBL21349942

Clc1ccc2c(c1)C(c1ccccc1)(c1ccccc1)c1cc(Br)c3oc4ccccc4c3c1-2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 6/20 0.36
▸ PTPRC P08575 1/20 0.33
▸ PTPRF P10586 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ PTPRA P18433 1/20 0.33
▸ PTPRB P23467 1/20 0.33
▸ PTPN6 P29350 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ PTPN12 Q05209 1/20 0.33
▸ CDC14B O60729 3/20 0.32
▸ CDC14A Q9UNH5 3/20 0.32
▸ IGF1R P08069 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ PDK2 Q15119 1/20 0.30

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
SCHEMBL22694762 0.84 AHR (0.39) AHRPTPRCPTPRFPTPN1PTPRA
SCHEMBL21031788 0.84 AHR (0.36) AHRPTPRCPTPRFPTPN1PTPRA
SCHEMBL20927644 0.84 AHR (0.38) AHRPTPRCPTPRFPTPN1PTPRA
SCHEMBL21350244 0.83 AHR (0.35) AHRIGF1RALOX5MAPK1SMN1; SMN2
SCHEMBL21349602 0.82 AHR (0.43) AHRIGF1R
SCHEMBL21031786 0.82 AHR (0.34) AHRCDC14BCDC14AALOX5PDK2
SCHEMBL17917522 0.81 PTPRC (0.36) AHRPTPRCPTPRFPTPN1PTPRA
SCHEMBL21349995 0.81 AHR (0.37) AHRCDC14BCDC14AIGF1RALOX5
SCHEMBL18927390 0.80 NMUR2 (0.33) PTPRCPTPRFPTPN1PTPRAPTPRB
SCHEMBL16219702 0.80 PDK2 (0.38) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3844242-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-06-22 — — EP disclosed
US-20220140248-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-05-05 — — US disclosed
US-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-01-07 — — US disclosed
WO-2020043640-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-03-05 — — WO disclosed
WO-2019170572-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-12 — — 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-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM AHR 3734/4885PTPRC 3705/4885PTPRF 3727/4885
US-20220140248-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM AHR 3734/4885PTPRC 3705/4885PTPRF 3727/4885

“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.

Send feedback