SCHEMBL5794442

SCHEMBL5794442

COc1ccccc1-c1nc2ccc(-c3ccc(Cl)cc3)cc2c(=O)o1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.71
C1R P00736 5/20 0.66
KLK7 P49862 7/20 0.59
KLK14 Q9P0G3 7/20 0.59
KLK5 Q9Y337 7/20 0.59
CTSG P08311 6/20 0.59
PRSS1 P07477 1/20 0.59
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
KDM4E B2RXH2 2/20 0.53
NPC1 O15118 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 1/20 0.53
CTRC Q99895 2/20 0.52
APEX1 P27695 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL9984612 0.83 ELANE (1.00) ELANEC1RKLK7KLK14KLK5
SCHEMBL5793545 0.82 C1R (0.76) ELANEC1RKLK7KLK14KLK5
SCHEMBL5790698 0.81 C1R (0.72) ELANEC1RKLK7KLK14KLK5
SCHEMBL30366271 0.80 C1R (1.00) ELANEC1RKLK7KLK14KLK5
SCHEMBL692226 0.80 C1R (1.00) ELANEC1RKLK7KLK14KLK5
SCHEMBL913690 0.79 ELANE (0.74) ELANEC1RKLK7KLK14KLK5
SCHEMBL5921767 0.78 C1R (0.63) ELANEC1RKLK7KLK14KLK5
SCHEMBL914093 0.77 C1R (0.66) ELANEC1RKLK7KLK14KLK5
SCHEMBL5387023 0.77 C1R (0.66) ELANEC1RKLK7KLK14KLK5
SCHEMBL914380 0.77 C1R (0.70) ELANEC1RKLK7KLK14KLK5

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