SCHEMBL7490338

SCHEMBL7490338

CC(=O)OOc1cccc(CN2CCC[C@H]2c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 11/20 0.72
POLB P06746 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
PTGER4 P35408 2/20 0.40
PTGER3 P43115 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SPHK1 Q9NYA1 1/20 0.39
TBXA2R P21731 1/20 0.39
PTGER2 P43116 1/20 0.39
PTGDR Q13258 1/20 0.39
NR4A2 P43354 2/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL7487193 1.00 PTGIR (0.72) PTGIRPOLBCD274PTGER4PTGER3
SCHEMBL8549446 0.92 PTGIR (0.64) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL8546649 0.92 PTGIR (0.64) PTGIRPTGER4PTGER3TBXA2RPTGER2
SCHEMBL7490346 0.91 PTGIR (0.75) PTGIRPOLBCD274PTGER4PTGER3
SCHEMBL7487199 0.91 PTGIR (0.75) PTGIRPOLBCD274PTGER4PTGER3
SCHEMBL6611962 0.86 PTGIR (0.86) PTGIRPOLBCD274PTGER4PTGER3
SCHEMBL7483613 0.86 PTGIR (0.86) PTGIRPOLBCD274PTGER4PTGER3
SCHEMBL7485700 0.84 PTGIR (0.69) PTGIRCD274KDM4EALDH1A1
SCHEMBL7487768 0.84 PTGIR (1.00) PTGIRPOLBCD274PTGER4PTGER3
SCHEMBL7488410 0.84 PTGIR (1.00) PTGIRPOLBCD274PTGER4PTGER3

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-B1 4,5-DIARYL OXAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2002-09-18 EP claimed