SCHEMBL5793545

SCHEMBL5793545

COc1ccc2nc(-c3ccccc3OC)oc(=O)c2c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C1R P00736 2/20 0.76
CTSG P08311 8/20 0.67
KLK7 P49862 8/20 0.67
KLK14 Q9P0G3 8/20 0.67
KLK5 Q9Y337 8/20 0.67
CTRC Q99895 2/20 0.67
PRSS1 P07477 1/20 0.65
ELANE P08246 2/20 0.65
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
ALDH1A1 P00352 4/20 0.55
MAPT P10636 3/20 0.55
KDM4E B2RXH2 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 1/20 0.55
LMNA P02545 1/20 0.55
RAB9A P51151 1/20 0.55
HPGD P15428 2/20 0.55
F2 P00734 1/20 0.55
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL5921134 0.89 C1R (0.68) C1RCTSGKLK7KLK14KLK5
SCHEMBL914361 0.86 C1R (0.74) C1RCTSGKLK7KLK14KLK5
SCHEMBL5790698 0.86 C1R (0.72) C1RCTSGKLK7KLK14KLK5
SCHEMBL692226 0.85 C1R (1.00) C1RCTSGKLK7KLK14KLK5
SCHEMBL30366271 0.85 C1R (1.00) C1RCTSGKLK7KLK14KLK5
SCHEMBL5371767 0.83 C1R (0.69) C1RCTSGKLK7KLK14KLK5
SCHEMBL5794442 0.82 ELANE (0.71) C1RCTSGKLK7KLK14KLK5
SCHEMBL5387023 0.82 C1R (0.66) C1RCTSGKLK7KLK14KLK5
SCHEMBL914093 0.82 C1R (0.66) C1RCTSGKLK7KLK14KLK5
SCHEMBL914380 0.82 C1R (0.70) C1RCTSGKLK7KLK14KLK5

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-2006012577-A2 QUINAZOLINONE DERIVATIVES USEFUL FOR THE REGULATION OF GLUCOSE HOMEOSTASIS AND FOOD INTAKE BAYER PHARMACEUTICALS CORPORATION (US) 2006-02-02 WO disclosed