SCHEMBL7718288

SCHEMBL7718288

CC(C)(C)[Si](Oc1cccc2c1CCC(O)C(COC(=O)N(c1ccccc1)c1ccccc1)C2)(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 17/20 0.51
PTGDR Q13258 8/20 0.40
PTGER3 P43115 2/20 0.40
PTGER1 P34995 1/20 0.40
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ACHE P22303 1/20 0.35
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
PTGER4 P35408 1/20 0.34
PTGER2 P43116 1/20 0.34

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
SCHEMBL7776652 0.89 PTGIR (0.66) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7713214 0.85 PTGIR (0.59) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7776674 0.84 PTGIR (0.42) PTGIRPTGDRPTGER3PTGER1ACHE
SCHEMBL7772412 0.84 PTGIR (0.42) PTGIRPTGDRPTGER3PTGER1ACHE
SCHEMBL7772415 0.84 PTGIR (0.42) PTGIRPTGDRPTGER3PTGER1ACHE
SCHEMBL7718891 0.82 DRD2 (0.36) PTGIRPTGDRCA1CA2ACHE
SCHEMBL7718887 0.81 PTGIR (0.40) PTGIRPTGDRPTGER3PTGER1PTGER4
SCHEMBL7716590 0.81 PTGIR (0.77) PTGIRPTGDRPTGER3PTGER1
SCHEMBL7717816 0.80 PTGIR (0.49) PTGIRPTGDRPTGER3PTGER1CA1
SCHEMBL7778597 0.80 PTGIR (0.40) PTGIRPTGDRPTGER3PTGER1ACHE

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
US-6384072-B1 CARBAMYL SUBSTITUTED COMPOUNDS WITH ETHER GROUPS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 US disclosed