SCHEMBL30459434

SCHEMBL30459434

COc1cc(-c2cc(C(=O)O)ncn2)ccc1F

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMO O15229 20/20 0.72

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
SCHEMBL24243059 1.00 KMO (0.72) KMO
Water SCHEMBL25259674 0.96 KMO (0.67) KMO
SCHEMBL24243057 0.88 KMO (0.56) KMO
SCHEMBL30459990 0.88 KMO (0.56) KMO
SCHEMBL14741878 0.84 KMO (1.00) KMO
SCHEMBL1937382 0.83 KMO (1.00) KMO
SCHEMBL1938425 0.81 KMO (1.00) KMO
Lithium Ion SCHEMBL25273615 0.79 KMO (0.95) KMO
SCHEMBL1937407 0.79 KMO (1.00) KMO
SCHEMBL14742234 0.79 KMO (1.00) 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
CN-116323583-A Heterobiaryl compounds and imaging agents for imaging huntingtin CHDI基金会股份有限公司 2023-06-23 CN disclosed