SCHEMBL20032572

SCHEMBL20032572

CC(=O)[C@H]1C[C@@H]1C(=O)c1cc(Cl)c2c(c1)CC(C)CO2

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.37

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
SCHEMBL21231402 0.90 KMO (0.49) KMO
SCHEMBL16614133 0.90 KMO (0.49) KMO
SCHEMBL18084711 0.88 KMO (0.36) KMO
SCHEMBL21231366 0.88 KMO (0.36) KMO
SCHEMBL20032577 0.85 KMO (0.39) KMO
SCHEMBL21218966 0.75 KMO (0.51) KMO
SCHEMBL16600309 0.75 KMO (0.51) KMO
SCHEMBL16600346 0.75 KMO (0.51) KMO
SCHEMBL21231297 0.75 KMO (0.51) KMO
SCHEMBL20032575 0.74 NPC1 (0.45) KMO

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-9938252-B2 Kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use thereof CHDI FOUNDATION, INC. (US) 2018-04-10 US disclosed