SCHEMBL24349727

SCHEMBL24349727

O=C(O)CC1(CC2(CC(=O)O)c3cccnc3-c3ncccc32)c2cccnc2-c2ncccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ MAPT P10636 2/20 0.38
▸ CDC25B P30305 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ BLM P54132 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ AGER Q15109 1/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ LMNA P02545 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ PDK2 Q15119 2/20 0.35
▸ EGLN2 Q96KS0 1/20 0.34

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
SCHEMBL24349733 0.89 KMT2A (0.49) KDM4ETDP1CDC25BNPSR1TSHR
SCHEMBL24349729 0.83 APEX1 (0.51) KDM4ETDP1MAPTCDC25BNPSR1
SCHEMBL24372357 0.82 KMT2A (0.51) KDM4ETDP1CDC25BNPSR1TSHR
SCHEMBL24349732 0.81 TP53 (0.39) KDM4ETDP1MAPTNPSR1L3MBTL1
SCHEMBL24349769 0.81 CYP19A1 (0.42) KDM4ETDP1MAPTTSHRALDH1A1
SCHEMBL24349323 0.79 APEX1 (0.59) KDM4ETDP1MAPTCDC25BNPSR1
SCHEMBL24349771 0.79 LMNA (0.43) KDM4EMAPTTSHRALDH1A1CYP3A4
SCHEMBL24350122 0.76 NPSR1 (0.35) KDM4ETDP1MAPTCDC25BNPSR1
SCHEMBL24349723 0.74 APEX1 (0.60) KDM4ETDP1CDC25BNPSR1TSHR
SCHEMBL24349324 0.73 CYP19A1 (0.44) KDM4ETDP1MAPTALDH1A1CYP3A4

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 KDM4E 2174/4885TDP1 1762/4885MAPT 1644/4885

“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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