SCHEMBL27056012

SCHEMBL27056012

CC1(C)CC2C3NC(C(OC(=O)c4ccccc4)C3OC(=O)c3ccccc3)C2C(C)(C)C1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.47
▸ TSHR P16473 2/20 0.40
▸ CHRNA7 P36544 2/20 0.39
▸ CES2 O00748 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ ABCB1 P08183 4/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ HTR3E A5X5Y0 2/20 0.35
▸ HTR3B O95264 2/20 0.35
▸ HTR3A P46098 2/20 0.35
▸ HTR3D Q70Z44 2/20 0.35
▸ HTR3C Q8WXA8 2/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ OPRD1 P41143 1/20 0.35

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
SCHEMBL27056018 0.82 GAA (0.43) GAATSHRCHRNA7KMT2AABCB1
SCHEMBL27056019 0.81 GAA (0.48) GAATSHRCHRNA7KMT2AMEN1
SCHEMBL27052191 0.80 GAA (0.46) GAATSHRCHRNA7CES2KMT2A
SCHEMBL27058565 0.80 GAA (0.48) GAATSHRCHRNA7CES2KMT2A
SCHEMBL27052212 0.79 GAA (0.45) GAATSHRKMT2AABCB1MEN1
SCHEMBL27059399 0.75 CHRNA7 (0.49) GAACHRNA7KMT2AMEN1CHRM2
SCHEMBL27056016 0.75 CHRNA7 (0.49) GAACHRNA7KMT2AMEN1CHRM2
SCHEMBL27059324 0.74 CHRM2 (0.52) GAACHRNA7KMT2AMEN1CHRM2
SCHEMBL27055817 0.74 CHRNA7 (0.51) GAACHRNA7KMT2AMEN1CHRM2
SCHEMBL27058566 0.74 GAA (0.42) GAATSHRCHRNA7CES2KMT2A

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 GAA 4343/4885TSHR 1885/4885CHRNA7 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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