SCHEMBL25128669

SCHEMBL25128669

CC(C)(C)c1ccc(-c2cc(C(C)(C)C)ccc2N(c2ccc(C(C)(C)C)cc2)c2cc(C(C)(C)C)cc(Nc3ccc4c(c3)C(C)(C)CCC4(C)C)c2Cl)cc1

nearest known ligand 0.31

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 1/20 0.31
▸ JAK3 P52333 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ CYP26A1 O43174 1/20 0.30
▸ PGR P06401 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ ADORA3 P0DMS8 1/20 0.30
▸ RARA P10276 1/20 0.30
▸ RARB P10826 1/20 0.30
▸ RARG P13631 1/20 0.30
▸ TBXA2R P21731 1/20 0.30
▸ BLVRB P30043 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL25128679 0.90 CYP26A1 (0.34) MEN1CYP26A1PGRCYP3A4ADORA3
SCHEMBL29292671 0.82 CNR1 (0.32) —
SCHEMBL25126829 0.81 CYP26A1 (0.32) MEN1CYP26A1PGRCYP3A4ADORA3
SCHEMBL25128120 0.80 KDM4E (0.32) —
SCHEMBL25128111 0.80 KIF11 (0.30) —
SCHEMBL25126778 0.78 RXRA (0.32) CYP26A1
SCHEMBL23444328 0.78 RARA (0.39) JAK2JAK3MEN1CYP26A1PGR
SCHEMBL22795138 0.78 — —
SCHEMBL26625478 0.76 CYP1A2 (0.33) —
SCHEMBL23445678 0.75 RARA (0.40) JAK2JAK3MEN1CYP26A1PGR

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-20230096132-A1 CYCLOALKANE-FUSED POLYCYCLIC AROMATIC COMPOUND KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-03-30 — — 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-20230096132-A1 CYCLOALKANE-FUSED POLYCYCLIC AROMATIC COMPOUND LAGE3, ELOC, ELOB JAK2 4114/4885JAK3 4302/4885MEN1 3848/4885

“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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