SCHEMBL24350122

SCHEMBL24350122

O=C(O)CC1(CC(=O)O)C2=CCCC=C2c2ncccc21

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CYP1A2 P05177 2/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CDC25B P30305 2/20 0.32
▸ PDK2 Q15119 2/20 0.32
▸ MAPT P10636 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ AGER Q15109 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL24350123 0.85 CYP19A1 (0.36) NPSR1GAALMNAKDM4ETDP1
SCHEMBL24350117 0.83 LMNA (0.36) LMNAKDM4ECYP1A2CYP2C19KMT2A
SCHEMBL24349727 0.76 KDM4E (0.43) NPSR1GAALMNAKDM4ETDP1
SCHEMBL24372357 0.76 KMT2A (0.51) NPSR1GAALMNAKDM4ETDP1
SCHEMBL24349286 0.74 NPC1 (0.37) NPSR1GAAKDM4ECYP2C19KMT2A
SCHEMBL24349733 0.73 KMT2A (0.49) NPSR1GAALMNAKDM4ETDP1
SCHEMBL24349719 0.70 KDM4E (0.35) GAAKDM4ECYP2C19KMT2AMAPT
SCHEMBL24349333 0.70 CYP1A2 (0.33) NPSR1GAALMNAKDM4ETDP1
SCHEMBL24349323 0.67 APEX1 (0.59) NPSR1KDM4ETDP1CYP1A2CYP2C19
SCHEMBL24349729 0.65 APEX1 (0.51) NPSR1KDM4ETDP1CYP1A2CYP2C19

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 NPSR1 2314/4885GAA 4399/4885LMNA 3304/4885

“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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