SCHEMBL29270754

SCHEMBL29270754

CC(C)(C[C@H]1CSc2cc(F)c(C#N)cc2NC1=O)NC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.32
▸ LMNA P02545 1/20 0.32

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
SCHEMBL29270801 0.89 LMNA (0.35) LMNA
SCHEMBL29270708 0.85 TP53 (0.34) LMNA
SCHEMBL29270724 0.84 SSTR4 (0.36) LMNA
SCHEMBL29270822 0.80 PLAT (0.30) —
SCHEMBL29270820 0.78 HDAC1 (0.33) —
SCHEMBL29270722 0.77 CHRM2 (0.38) —
SCHEMBL29270744 0.75 TP53 (0.34) LMNA
SCHEMBL29270742 0.75 HDAC1 (0.41) LMNA
SCHEMBL29270757 0.73 CYP2C9 (0.33) —
SCHEMBL29796711 0.73 GAA (0.39) —

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
Send feedback