SCHEMBL24349768

SCHEMBL24349768

CC(CC1(CC2(CC(C)C(=O)Oc3ccccc3)c3ccccc3-c3ncccc32)c2ccccc2-c2ncccc21)C(=O)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.44
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP2 O95551 2/20 0.39
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ CYP2D6 P10635 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ ITGA4 P13612 1/20 0.33
▸ ITGB7 P26010 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ HRH1 P35367 1/20 0.32

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
SCHEMBL24349762 0.95 PDK2 (0.46) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24349772 0.93 PDK2 (0.36) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24349322 0.88 PDK2 (0.38) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24349726 0.87 PDK2 (0.47) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL15691752 0.87 APEX1 (0.42) PDK2CYP1A2CYP2C19LMNACYP2D6
SCHEMBL24349767 0.86 PDK2 (0.46) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24349730 0.86 PDK2 (0.50) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24350114 0.82 PDK2 (0.49) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24350115 0.81 PDK2 (0.48) PDK2CYP1A2CYP2C19KMT2ATDP2
SCHEMBL24372208 0.81 KMT2A (0.33) KMT2AGAANPSR1CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3988599-B1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND MITSUBISHI CHEM CORP (JP) 2023-10-18 — — EP disclosed
EP-3988599-A1 THERMOPLASTIC RESIN, OPTICAL FILM MADE THEREFROM, DIOL COMPOUND, DIESTER COMPOUND Mitsubishi Chemical Corporation (JP) 2022-04-27 — — EP disclosed
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 PDK2 3967/4885CYP1A2 298/4885CYP2C19 1474/4885

“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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