SCHEMBL27134208

SCHEMBL27134208

CC(C)C12CCC(C)(CC1)C(OC(=O)c1ccc(-c3ccccc3)cc1)C2OC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 1/20 0.47
▸ CD274 Q9NZQ7 1/20 0.47
▸ SCN1A P35498 1/20 0.45
▸ SCN2A Q99250 1/20 0.45
▸ SCN3A Q9NY46 1/20 0.45
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ EGFR P00533 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ SLC1A5 Q15758 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTR3E A5X5Y0 1/20 0.36
▸ HTR3B O95264 1/20 0.36
▸ CHRNA7 P36544 1/20 0.36
▸ HTR3A P46098 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
SCHEMBL27138250 0.92 GAA (0.46) GAAESR1NR1I2HTR3EHTR3B
SCHEMBL27134010 0.92 GAA (0.46) GAAESR1NR1I2HTR3EHTR3B
SCHEMBL27135056 0.89 SCN1A (0.54) PDCD1CD274SCN1ASCN2ASCN3A
SCHEMBL27134260 0.88 GAA (0.42) SCN1ASCN2ASCN3AGAAESR1
SCHEMBL27138253 0.86 ESR1 (0.42) SCN1ASCN2ASCN3AGAAESR1
SCHEMBL27134203 0.86 ESR1 (0.42) SCN1ASCN2ASCN3AGAAESR1
SCHEMBL27134059 0.85 GAA (0.48) GAAHTR3EHTR3BCHRNA7HTR3A
SCHEMBL27134207 0.85 POLB (0.45) GAASMN1; SMN2ESR1NR1I2KDM4E
SCHEMBL27134209 0.84 CA1 (0.43) ESR1NR1I2RAB9AKDM4ENPC1
SCHEMBL26709875 0.84 CA1 (0.43) ESR1NR1I2RAB9AKDM4ENPC1

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-20240067764-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2024-02-29 — — US disclosed
US-20240067597-A1 ESTER COMPOUND MITSUI CHEMICALS, INC. (JP) 2024-02-29 — — 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-20240067597-A1 ESTER COMPOUND PPT1, GPER1, TCP1 PDCD1 4523/4885CD274 4704/4885SCN1A 4025/4885

“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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