SCHEMBL29538570

SCHEMBL29538570

Cc1c(-c2ncco2)sc2c1c(=O)n(C(C)(C)C(=O)O)c(=O)n2C[C@@H](OC1CCOCC1)c1ccccc1Cl

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 18/20 0.76
ACACB O00763 13/20 0.76

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
SCHEMBL14936329 1.00 ACACA (0.76) ACACAACACB
SCHEMBL14936330 1.00 ACACA (0.76) ACACAACACB
SCHEMBL14945404 1.00 ACACA (0.76) ACACAACACB
SCHEMBL14936078 0.94 ACACA (0.85) ACACAACACB
SCHEMBL14936079 0.94 ACACA (0.85) ACACAACACB
SCHEMBL29538338 0.94 ACACA (0.85) ACACAACACB
SCHEMBL14945446 0.93 ACACA (0.78) ACACAACACB
SCHEMBL29453872 0.93 ACACA (0.78) ACACAACACB
SCHEMBL14936267 0.93 ACACA (0.78) ACACAACACB
SCHEMBL14936266 0.93 ACACA (0.78) ACACAACACB

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-109970760-B ACC inhibitors and uses thereof 吉利德阿波罗公司 2022-04-26 CN disclosed