SCHEMBL7486168

SCHEMBL7486168

O=C(NCCc1ccccn1)c1cccc(C[C@@H]2CCCC=C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.70
PTGIR P43119 4/20 0.70
PTGER1 P34995 1/20 0.70
PTGER3 P43115 1/20 0.59
PARP1 P09874 1/20 0.42
NAMPT P43490 4/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 2/20 0.38
PTGFR P43088 1/20 0.38
ALDH1A1 P00352 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL7486175 1.00 PTGER4 (0.70) PTGER4PTGIRPTGER1PTGER3PARP1
Hydrochloric Acid SCHEMBL7481069 0.99 PTGER4 (0.69) PTGER4PTGIRPTGER1PTGER3PARP1
Hydrochloric Acid SCHEMBL7481075 0.99 PTGER4 (0.69) PTGER4PTGIRPTGER1PTGER3PARP1
SCHEMBL7477735 0.88 PTGER4 (0.73) PTGER4PTGIRPTGER1PTGER3PARP1
SCHEMBL7475495 0.88 PTGER4 (0.78) PTGER4PTGIRPTGER1PTGER3PARP1
SCHEMBL7476217 0.86 PTGIR (0.79) PTGER4PTGIRPTGER1PTGER3KMT2A
SCHEMBL7475010 0.86 PTGER4 (0.68) PTGER4PTGIRPTGER1PTGER3PARP1
SCHEMBL7844739 0.85 PTGER4 (0.69) PTGER4PTGIRPTGER1PTGER3PARP1
SCHEMBL7481226 0.84 PTGIR (0.76) PTGER4PTGIRPTGER1PTGER3TDP1
SCHEMBL7476540 0.84 PTGER4 (0.73) PTGER4PTGIRPTGER1PTGER3NAMPT

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
US-6437146-B1 MESANGIAL PROLIFERATIVE GLOMERULONEPHRITIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-08-20 US disclosed
EP-1115712-A1 OXAZOLE COMPOUNDS AS PROSTAGLANDIN E2 AGONISTS OR ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-07-18 EP disclosed
WO-2000018744-A1 OXAZOLE COMPOUNDS AS PROSTAGLANDIN E2 AGONISTS OR ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-04-06 WO disclosed