SCHEMBL21794372

SCHEMBL21794372

OC(c1ccccc1)(c1ccccc1)c1cc(Cl)ccc1-c1cccc2oc3ccccc3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.43
CDC14B O60729 5/20 0.36
CDC14A Q9UNH5 5/20 0.36
CYP19A1 P11511 3/20 0.36
ALOX5 P09917 1/20 0.34
IDO1 P14902 2/20 0.34
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33
GABRA6 Q16445 1/20 0.33
GABRG1 Q8N1C3 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
SCHEMBL10109059 0.86 ALOX5 (0.50) AHRCDC14BCDC14ACYP19A1ALOX5
SCHEMBL21349601 0.85 AHR (0.37) AHRCDC14BCDC14ACYP19A1
SCHEMBL18356959 0.85 AHR (0.45) AHRCDC14BCDC14AALOX5IDO1
SCHEMBL21343402 0.78 CDC14B (0.43) CDC14BCDC14AALOX5MAOACYP3A4
SCHEMBL17307494 0.77 ALOX5 (0.47) AHRCDC14BCDC14ACYP19A1ALOX5
SCHEMBL22760344 0.76 AHR (0.73) AHRIDO1GABRPGABRDGABRA1
SCHEMBL27334646 0.76 AHR (0.58) AHRIDO1GABRPGABRDGABRA1
SCHEMBL16219725 0.75 CYP19A1 (0.39) CYP19A1CYP3A4CYP3A5
SCHEMBL18786338 0.75 CYP1A2 (0.41) CYP19A1CYP3A4CYP3A5
SCHEMBL16491684 0.74 AHR (0.51) AHRALOX5IDO1GABRPGABRD

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-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

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 3734/4885CDC14B 4597/4885CDC14A 4518/4885
US-20220140248-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM AHR 3734/4885CDC14B 4597/4885CDC14A 4518/4885

“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.