SCHEMBL29270822

SCHEMBL29270822

CC(C)(C[C@H]1CSc2cc(F)c(-c3nnc(C(C)(C)C)o3)cc2NC1=O)NC(=O)O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PLAT P00750 1/20 0.30
▸ BTK Q06187 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
SCHEMBL29270739 0.91 — —
SCHEMBL29270757 0.85 CYP2C9 (0.33) —
SCHEMBL29270801 0.82 LMNA (0.35) —
SCHEMBL29270820 0.81 HDAC1 (0.33) —
SCHEMBL29270754 0.80 AKR1B1 (0.32) —
SCHEMBL29270708 0.79 TP53 (0.34) —
SCHEMBL29270721 0.78 CNR2 (0.32) —
SCHEMBL31628245 0.77 PLAT (0.32) PLAT
SCHEMBL29796810 0.77 GAA (0.36) PLATBTK
SCHEMBL26961690 0.77 GAA (0.36) PLATBTK

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
CN-116964048-A Bicyclic tetrahydroazepine derivatives for the treatment of cancer 豪夫迈·罗氏有限公司 2023-10-27 — — CN disclosed
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