SCHEMBL21343381

SCHEMBL21343381

CC(C)(O)c1ccccc1-c1cccc2oc3ccccc3c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC14B O60729 4/20 0.48
▸ CDC14A Q9UNH5 4/20 0.48
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ CYP2C19 P33261 2/20 0.40
▸ MAOA P21397 4/20 0.39
▸ ADRB2 P07550 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ HPGD P15428 4/20 0.36
▸ HSD17B10 Q99714 4/20 0.36
▸ CYP3A4 P08684 3/20 0.36
▸ GLA P06280 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ PGAM1 P18669 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ ALOX5 P09917 2/20 0.35
▸ TP53 P04637 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
SCHEMBL20205472 0.89 CDC14B (0.43) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL21971989 0.87 CDC14B (0.46) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL21343396 0.86 CDC14B (0.44) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL24519947 0.86 ALOX5 (0.48) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL19132014 0.84 NMUR2 (0.41) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL18356959 0.84 AHR (0.45) CDC14BCDC14AMAOAADRB2MAPT
SCHEMBL4554342 0.83 ALOX5 (0.54) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL20205417 0.82 ALOX5 (0.50) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL3081231 0.80 ALDH1A1 (0.52) CDC14BCDC14AMEN1KMT2ACYP2C19
SCHEMBL30550556 0.80 ALDH1A1 (0.52) CDC14BCDC14AMEN1KMT2ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-01-07 — — US disclosed
WO-2019170578-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 (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-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM CDC14B 4597/4885CDC14A 4518/4885MEN1 331/4885

“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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