SCHEMBL6888064

SCHEMBL6888064

O=CCc1cc(Cl)ccc1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 16/20 0.55
STAT3 P40763 1/20 0.52
KMT2A Q03164 1/20 0.51

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
SCHEMBL6203294 0.84 MAOB (0.51)
SCHEMBL6881308 0.82 L3MBTL1 (0.48) PTGER1
SCHEMBL6887813 0.82 PTGER1 (0.61) PTGER1
SCHEMBL2722375 0.82 USP28 (0.60) PTGER1
SCHEMBL1578301 0.82 NPC1 (0.47) KMT2A
SCHEMBL4720836 0.81 PTGER1 (0.56) PTGER1STAT3
SCHEMBL872421 0.81 HTR1A (0.61) PTGER1KMT2A
SCHEMBL1196687 0.80 CCR5 (0.64) PTGER1STAT3KMT2A
SCHEMBL562155 0.80 PTGER1 (0.55) PTGER1STAT3
SCHEMBL2954443 0.80 MAPT (0.60) PTGER1

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
WO-2004110351-A2 HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS ANADYS PHARMACEUTICALS, INC. (US) 2004-12-23 WO disclosed