SCHEMBL30812903

SCHEMBL30812903

COc1cc2c(S(N)(=O)=O)cc(NC(=O)Cc3ccccc3Cl)cc2cn1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 20/20 0.56

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
SCHEMBL23619955 1.00 P2RX4 (0.56) P2RX4
SCHEMBL23619695 0.91 P2RX4 (0.57) P2RX4
SCHEMBL30812842 0.91 P2RX4 (0.57) P2RX4
SCHEMBL30812912 0.91 P2RX4 (0.53) P2RX4
SCHEMBL25144552 0.91 P2RX4 (0.53) P2RX4
SCHEMBL23619959 0.89 P2RX4 (0.54) P2RX4
SCHEMBL30812831 0.89 P2RX4 (0.54) P2RX4
SCHEMBL23619920 0.88 P2RX4 (0.60) P2RX4
SCHEMBL30812835 0.88 P2RX4 (0.60) P2RX4
SCHEMBL23619919 0.86 P2RX4 (0.56) P2RX4

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-114901642-B Fused ring compound and application thereof 武汉朗来科技发展有限公司 2024-02-23 CN disclosed