SCHEMBL8675199

SCHEMBL8675199

O=C(O)c1ccccc1CCCc1cc(C(=NO)c2ccccc2)ccc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 4/20 0.54
PTGER4 P35408 2/20 0.54
PTGER3 P43115 2/20 0.54
PTGER2 P43116 2/20 0.54
MTNR1B P49286 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FOLH1 Q04609 4/20 0.43
MRGPRX4 Q96LA9 3/20 0.42
MTNR1A P48039 3/20 0.42
NR4A2 P43354 1/20 0.41
CLCN2 P51788 1/20 0.40

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
SCHEMBL8675197 1.00 PTGER1 (0.54) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8324840 0.88 PTGER1 (0.67) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8323764 0.88 PTGER1 (0.67) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8676020 0.87 PTGER1 (0.54) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8678298 0.84 PTGER1 (0.58) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8675082 0.84 PTGER1 (0.57) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8675230 0.83 PTGER1 (0.56) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8676059 0.82 PTGER1 (0.57) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8674816 0.82 PTGER1 (0.55) PTGER1PTGER4PTGER3PTGER2MTNR1B
SCHEMBL8675205 0.80 PTGER1 (0.71) PTGER1PTGER4PTGER3PTGER2ALDH1A1

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-5811459-A PAIN RELIEVERS ZENECA LIMITED (GB) 1998-09-22 US disclosed