SCHEMBL8551740

SCHEMBL8551740

CC(=O)Oc1cc(CC2CCCC=C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)ccc1C

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 11/20 0.66
PTGER4 P35408 6/20 0.66
PTGER1 P34995 1/20 0.66
PTGER3 P43115 2/20 0.61
FABP4 P15090 2/20 0.35
FABP3 P05413 1/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TBXA2R P21731 1/20 0.34
PTGER2 P43116 1/20 0.34
PTGDR Q13258 1/20 0.34
LMNA P02545 2/20 0.33

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
SCHEMBL8551738 0.92 PTGIR (0.64) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7491532 0.89 PTGIR (0.68) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7490153 0.89 PTGIR (0.64) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL8548332 0.87 PTGIR (0.66) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7964078 0.87 PTGIR (0.74) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL9006710 0.86 PTGIR (0.75) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL8075231 0.86 PTGIR (0.75) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL8551042 0.86 PTGIR (0.60) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7493262 0.85 PTGIR (0.68) PTGIRPTGER4PTGER1PTGER3FABP4
SCHEMBL7959805 0.85 PTGIR (0.66) PTGIRPTGER4PTGER1PTGER3FABP4

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
EP-0842161-A1 4,5-DIARYL OXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-20 EP disclosed