SCHEMBL25128679

SCHEMBL25128679

CC(C)(C)c1ccc(N(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 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 6/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ RARA P10276 2/20 0.34
▸ RARB P10826 2/20 0.34
▸ RARG P13631 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ PGR P06401 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ TBXA2R P21731 1/20 0.34
▸ BLVRB P30043 1/20 0.34
▸ CYP26B1 Q9NR63 5/20 0.34
▸ RXRA P19793 2/20 0.33
▸ RXRB P28702 2/20 0.33
▸ RXRG P48443 1/20 0.31
▸ OPRD1 P41143 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ TSHR P16473 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
SCHEMBL25126829 0.90 CYP26A1 (0.32) CYP26A1MEN1CYP3A4RARARARB
SCHEMBL25128669 0.90 JAK2 (0.31) CYP26A1MEN1CYP3A4RARARARB
SCHEMBL25126778 0.88 RXRA (0.32) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL25128111 0.87 KIF11 (0.30) —
SCHEMBL23589607 0.84 AKR1C3 (0.36) MEN1KMT2AALDH1A1MAPK1
SCHEMBL25127093 0.81 — —
SCHEMBL25127074 0.79 AKR1C3 (0.30) —
SCHEMBL21846305 0.78 RXRA (0.37) CYP26A1CYP26B1RXRARXRBRXRG
SCHEMBL25128050 0.76 RXRA (0.38) CYP26A1RARARARBRARGCYP26B1
SCHEMBL23116372 0.76 CYP26A1 (0.47) CYP26A1MEN1CYP3A4RARARARB

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 CYP26A1 3367/4885MEN1 3848/4885CYP3A4 2615/4885

“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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