SCHEMBL6763505

SCHEMBL6763505

CNC(=O)c1ccc2[nH]c(=O)n(C)c2c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.56
B3GNT2 Q9NY97 8/20 0.48
LMNA P02545 1/20 0.47
PGR P06401 2/20 0.46
HTR3A P46098 1/20 0.44
PSMB8 P28062 1/20 0.43
ACSS2 Q9NR19 2/20 0.42
LRRK2 Q5S007 1/20 0.42
MAPKAPK2 P49137 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL16548565 0.88 POLB (0.48) AURKALMNAHTR3A
SCHEMBL6766028 0.85 HTR3A (0.47) AURKAB3GNT2LMNAPGRHTR3A
SCHEMBL21156818 0.83 LMNA (0.51) B3GNT2LMNAPGRPSMB8LRRK2
SCHEMBL1759132 0.83 B3GNT2 (0.61) AURKAB3GNT2LMNAPGRMAOB
SCHEMBL1759187 0.82 CREBBP (0.51) B3GNT2LMNAPGRPSMB8MAOB
SCHEMBL25195141 0.81 LMNA (0.50) AURKAB3GNT2LMNAPGRPSMB8
SCHEMBL6763764 0.81 BRD4 (0.57) B3GNT2LMNAPGRMAPKAPK2MAOB
SCHEMBL12673423 0.79 B3GNT2 (0.49) B3GNT2LMNAPGRMAOB
SCHEMBL20660794 0.78 LMNA (0.46) AURKAB3GNT2LMNAPGRHTR3A
SCHEMBL21156822 0.78 LMNA (0.46) B3GNT2LMNAPGRHTR3AMAOB

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
US-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US disclosed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP disclosed