SCHEMBL27057307

SCHEMBL27057307

CPC12CCC(PC)(C1)C1CC(OC(=O)c3ccccc3)C(OC(=O)c3ccccc3)CC12

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR3E A5X5Y0 1/20 0.44
▸ HTR3B O95264 1/20 0.44
▸ CHRNA7 P36544 1/20 0.44
▸ HTR3A P46098 1/20 0.44
▸ HTR3D Q70Z44 1/20 0.44
▸ HTR3C Q8WXA8 1/20 0.44
▸ CHRM2 P08172 2/20 0.43
▸ CHRM4 P08173 2/20 0.43
▸ CHRM1 P11229 2/20 0.43
▸ CHRM3 P20309 2/20 0.43
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ KCNH2 Q12809 1/20 0.41

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
SCHEMBL27057377 0.88 GAA (0.42) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27059669 0.82 GAA (0.38) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27057660 0.80 GAA (0.47) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27107054 0.79 GAA (0.40) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27052345 0.79 GAA (0.48) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL24278797 0.79 CHRM2 (0.46) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27057357 0.79 GAA (0.50) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL25755384 0.79 CHRM2 (0.46) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27058566 0.78 GAA (0.42) HTR3EHTR3BCHRNA7HTR3AHTR3D
SCHEMBL27106974 0.77 GAA (0.41) HTR3EHTR3BCHRNA7HTR3AHTR3D

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-20240067763-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2024-02-29 — — US disclosed
US-20240025838-A1 ESTER COMPOUND MITSUI CHEMICALS, INC. (JP) 2024-01-25 — — 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-20240025838-A1 ESTER COMPOUND NR1H3, CYP4A11, H1-4 HTR3E 1981/4885HTR3B 1882/4885CHRNA7 3219/4885

“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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