SCHEMBL25443306

SCHEMBL25443306

Cc1cc(C(C)(C)C)cc(-c2c3ccc(C4CCCCC4)cc3cc[n+]2C)c1C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.33
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL25443258 0.99 BACE1 (0.32) BACE1
SCHEMBL25443308 0.92 BACE1 (0.32) BACE1
SCHEMBL25443262 0.90 BACE1 (0.30) BACE1
SCHEMBL25443305 0.89 BACE1 (0.33) BACE1CYP2C9
SCHEMBL25443273 0.89 BACE1 (0.36) BACE1
SCHEMBL25443314 0.89 BACE1 (0.36) BACE1
SCHEMBL25443310 0.89 BACE1 (0.36) BACE1
SCHEMBL25443349 0.89
SCHEMBL25443257 0.88 BACE1 (0.32) BACE1CYP2C9
SCHEMBL25443298 0.88 BACE1 (0.35) BACE1

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-11653559-B2 Metal complex containing a first ligand, a second ligand, and a third ligand Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-05-16 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-11653559-B2 Metal complex containing a first ligand, a second ligand, and a third ligand L1CAM, MLEC, PDCD1LG2 BACE1 2848/4885CYP1A2 2485/4885CYP2D6 2804/4885

“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.