SCHEMBL24349763

SCHEMBL24349763

CCOC(=O)CCC1(CC2(CCC(=O)OCC)c3ccccc3-c3ncccc32)c2ccccc2-c2ncccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ PDK2 Q15119 4/20 0.41
▸ HRH1 P35367 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ALDH3A1 P30838 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP2 O95551 4/20 0.38
▸ CYP4F2 P78329 1/20 0.36
▸ CYP4A11 Q02928 1/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36

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
SCHEMBL24350383 0.99 CYP1A2 (0.46) CYP1A2CYP2C19KMT2APDK2HRH1
SCHEMBL24350113 0.95 CYP1A2 (0.49) CYP1A2CYP2C19KMT2APDK2HRH1
SCHEMBL24349770 0.91 LMNA (0.41) CYP1A2CYP2C19KMT2APDK2LMNA
SCHEMBL24372159 0.88 KMT2A (0.46) CYP1A2CYP2C19KMT2APDK2LMNA
SCHEMBL24349773 0.88 CYP1A2 (0.49) CYP1A2CYP2C19KMT2APDK2HRH1
SCHEMBL24350382 0.87 KMT2A (0.45) CYP1A2CYP2C19KMT2APDK2LMNA
SCHEMBL24349317 0.86 LMNA (0.43) CYP1A2CYP2C19KMT2APDK2LMNA
SCHEMBL10008969 0.86 APEX1 (0.53) CYP1A2PDK2APEX1ALDH1A1TSHR
SCHEMBL17055507 0.85 APEX1 (0.51) CYP1A2PDK2APEX1ALDH1A1TSHR
SCHEMBL24349774 0.83 APEX1 (0.43) CYP1A2CYP2C19KMT2APDK2LMNA

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-20220081510-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND MITSUBISHI CHEMICAL CORPORATION (JP) 2022-03-17 — — 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-20220081510-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND RTF1, RNF10, RAD51 CYP1A2 298/4885CYP2C19 1474/4885KMT2A 525/4885

“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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