SCHEMBL8699097

SCHEMBL8699097

Cc1c(CCC(N)=O)cccc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 11/20 0.57
PDCD1 Q15116 4/20 0.57
PTGER4 P35408 3/20 0.49
PTGER3 P43115 3/20 0.49
PTGER1 P34995 2/20 0.49
PTGER2 P43116 2/20 0.49
PTGS1 P23219 1/20 0.46
FFAR4 Q5NUL3 1/20 0.44
MTNR1A P48039 1/20 0.43
FOLH1 Q04609 1/20 0.42
EPHX1 P07099 1/20 0.42
KMT2A Q03164 1/20 0.41

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
SCHEMBL8696466 0.93 CD274 (0.55) CD274PDCD1PTGER4PTGER3PTGER1
SCHEMBL7335526 0.85 TP53 (0.50) CD274PDCD1FFAR4MTNR1A
SCHEMBL29174155 0.84 CD274 (0.64) CD274PDCD1PTGER4PTGER3PTGER1
SCHEMBL6206188 0.82 PTGER4 (0.58) CD274PDCD1PTGER4PTGER3PTGER1
SCHEMBL8696572 0.81 CD274 (0.46) CD274PDCD1PTGER4PTGER3PTGER1
SCHEMBL8698313 0.79 CD274 (0.39) CD274PDCD1PTGER4PTGER3PTGER1
SCHEMBL8700812 0.78 S1PR1 (0.45) CD274PDCD1
SCHEMBL16589154 0.77 PTGER4 (0.53) PTGER4PTGER3PTGER1PTGER2PTGS1
SCHEMBL28813902 0.77 FFAR4 (0.53) CD274PDCD1PTGER4PTGER3PTGER1
SCHEMBL22591127 0.77 PTGER4 (0.56) CD274PTGER4PTGER3PTGER1PTGER2

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-5726319-A Biphenyl substituted dipeptide analogs promote release of growth hormone MERCK & CO., INC. (US) 1998-03-10 US disclosed