SCHEMBL28469826

SCHEMBL28469826

Cn1nnc(-c2cccc(-c3ccc(Cl)c(Cl)c3)c2)c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMO O15229 11/20 0.44
KDM2B Q8NHM5 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
PPP1CA P62136 1/20 0.40
GRM5 P41594 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
CNR1 P21554 1/20 0.39
SMO Q99835 1/20 0.38
RPA1 P27694 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL23294499 0.81 KMO (0.46) KMOKDM4CRPA1KCNH2
SCHEMBL16708689 0.80 POLB (0.45)
SCHEMBL12989454 0.79 NPC1 (0.41) KDM4CCNR1
SCHEMBL28014685 0.77 GPBAR1 (0.57) SMO
SCHEMBL15897047 0.73 TPMT (0.37)
SCHEMBL22608623 0.72 KMO (0.45) KMORXRARXRBRXRGCNR1
SCHEMBL29490706 0.72 KMO (0.45) KMORXRARXRBRXRGCNR1
SCHEMBL29102516 0.71 SLC6A3 (0.46) KMOPPP1CASMO
SCHEMBL3540530 0.69 KMO (0.66) KMORXRARXRBRPA1
SCHEMBL20659684 0.69 KDM2B (0.47) KMOKDM2BKDM4CGRM5RPA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114258390-A Glycolate oxidase inhibitors for disease treatment 生物马林药物股份有限公司 2022-03-29 CN disclosed
CN-111788187-A Glycolate oxidase inhibitors for disease treatment 生物马林药物股份有限公司 2020-10-16 CN disclosed