SCHEMBL9006885

SCHEMBL9006885

COc1cccc(CC2CCCC=C2c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.73

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 12/20 0.73
PTGER4 P35408 6/20 0.73
PTGER3 P43115 2/20 0.73
PTGER1 P34995 1/20 0.71
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TBXA2R P21731 1/20 0.40
PTGER2 P43116 1/20 0.40
PTGDR Q13258 1/20 0.40
FABP4 P15090 1/20 0.39

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
SCHEMBL7479094 1.00 PTGIR (0.73) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7949957 1.00 PTGIR (0.73) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7490131 0.97 PTGIR (0.69) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7495210 0.96 PTGIR (0.68) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7495199 0.96 PTGIR (0.68) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL8066610 0.94 PTGIR (0.72) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL8056718 0.94 PTGIR (0.72) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7949692 0.94 PTGIR (0.72) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7480950 0.92 PTGIR (0.65) PTGIRPTGER4PTGER3PTGER1RXRA
SCHEMBL7489473 0.89 PTGER4 (0.64) PTGIRPTGER4PTGER3PTGER1KDM4E

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-0736018-A1 4,5-DIARYLOXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-09 EP disclosed