SCHEMBL6688059

SCHEMBL6688059

CCCn1nnc2cc(C(=O)OC(=O)c3ccc4c(c3)nnn4C3CCCCC3)ccc21

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 10/20 0.60
MAPT P10636 4/20 0.55
RXFP1 Q9HBX9 4/20 0.55
TP53 P04637 3/20 0.55
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL6688047 0.90 HCAR3 (0.77) HCAR3MAPTRXFP1TP53
SCHEMBL12380480 0.78 HCAR3 (0.73) HCAR3MAPTLMNATSHR
SCHEMBL6044076 0.76 HCAR3 (1.00) HCAR3MAPTRXFP1TP53ALDH1A1
SCHEMBL27273144 0.75 HCAR3 (0.78) HCAR3MAPTRXFP1TP53ALDH1A1
SCHEMBL6044131 0.75 HCAR3 (1.00) HCAR3MAPTRXFP1TP53
SCHEMBL6044508 0.73 HCAR3 (1.00) HCAR3
SCHEMBL6044013 0.72 HCAR3 (1.00) HCAR3MAPTRXFP1TP53
SCHEMBL13153983 0.70 HCAR3 (0.60) HCAR3MAPTRXFP1TP53LMNA
SCHEMBL6043957 0.70 HCAR3 (1.00) HCAR3MAPTRXFP1TP53
SCHEMBL13153979 0.69 HCAR3 (0.57) HCAR3MAPTRXFP1TP53ALDH1A1

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
WO-2004041274-A1 BENZOTRIAZOLES AND METHODS OF PROPHYLAXIS OR TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ARENA PHARMACEUTICALS, INC. (US) 2004-05-21 WO claimed