SCHEMBL6930179

SCHEMBL6930179

O=C(Nc1ccc(Cl)cc1)c1ccc(O)c(C(=O)Nc2ccc(Cl)cc2)c1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 6/20 0.64
KLKB1 P03952 1/20 0.54
ALOX15 P16050 1/20 0.53
TMPRSS4 Q9NRS4 5/20 0.53
PNLIP P16233 1/20 0.51
PLAU P00749 2/20 0.51
P2RX4 Q99571 3/20 0.50
P2RX7 Q99572 3/20 0.50
KCNMA1 Q12791 1/20 0.50
F2 P00734 1/20 0.49
F10 P00742 1/20 0.49
PLG P00747 1/20 0.49
PLAT P00750 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL10428048 0.80 P2RX1 (0.57) P2RX1TMPRSS4PNLIPNPC1RAB9A
SCHEMBL29454776 0.78 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL2169619 0.78 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL15313832 0.78 BCL2L1 (0.63) P2RX1KLKB1ALOX15ALDH1A1LMNA
SCHEMBL21914835 0.77 P2RX1 (0.62) P2RX1KLKB1PNLIPNPC1RAB9A
SCHEMBL15313831 0.75 GPR27 (0.61) P2RX1GAAKMT2A
SCHEMBL2698725 0.75 PNLIP (0.82) P2RX1ALOX15TMPRSS4PNLIPPLAU
SCHEMBL7116292 0.75 P2RX1 (0.56) P2RX1PNLIPNPC1LMNAKMT2A
SCHEMBL10885167 0.74 PLG (0.71) P2RX1ALOX15P2RX4P2RX7PLG
SCHEMBL24460276 0.73 P2RX1 (0.77) P2RX1TMPRSS4PLAUP2RX4P2RX7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1100486-A4 MACROPHAGE SCAVENGER RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 2003-01-15 EP disclosed
EP-1100486-A1 MACROPHAGE SCAVENGER RECEPTOR ANTAGONISTS SmithKline Beecham Corporation (US) 2001-05-23 EP disclosed
WO-2000006147-A1 MACROPHAGE SCAVENGER RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-10 WO disclosed