SCHEMBL30812809

SCHEMBL30812809

CN(C)/C=N/S(=O)(=O)c1cc(NC(=O)Cc2ccccc2Cl)cc2c(O)nccc12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNJ5 P48544 4/20 0.48
KCNJ3 P48549 4/20 0.48
KCNJ6 P48051 3/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
POLB P06746 1/20 0.48
THRB P10828 1/20 0.48
ANO1 Q5XXA6 6/20 0.45
P2RX4 Q99571 9/20 0.43
RORA P35398 1/20 0.42
NR2E1 Q9Y466 1/20 0.42

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
SCHEMBL23619934 1.00 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL29162317 1.00 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619711 0.92 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619854 0.89 KCNJ6 (0.39) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619941 0.85 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619784 0.84 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619946 0.84 P2RX4 (0.42) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619766 0.83 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619998 0.83 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA
SCHEMBL23619937 0.83 KCNJ5 (0.48) KCNJ5KCNJ3KCNJ6ALDH1A1LMNA

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