SCHEMBL11604151

SCHEMBL11604151

CCCCCC(O)CCCN(CCCCC(C)CC(=O)O)S(C)(=O)=O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 6/20 0.50
▸ FFAR4 Q5NUL3 1/20 0.45
▸ FFAR1 O14842 1/20 0.45
▸ ACE2 Q9BYF1 1/20 0.42
▸ FAAH O00519 2/20 0.39
▸ NFKB1 P19838 1/20 0.38
▸ EPHX2 P34913 1/20 0.35

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
SCHEMBL11602008 0.83 FFAR4 (0.69) GPR84FFAR4FFAR1FAAH
SCHEMBL11602265 0.83 ACE2 (0.51) GPR84FFAR4FFAR1ACE2FAAH
SCHEMBL11601264 0.83 FFAR4 (0.69) GPR84FFAR4FFAR1FAAH
SCHEMBL11602010 0.83 FFAR4 (0.69) GPR84FFAR4FFAR1FAAH
SCHEMBL4964157 0.83 FFAR4 (0.69) GPR84FFAR4FFAR1FAAH
SCHEMBL11784233 0.82 GPR84 (0.51) GPR84FFAR4FFAR1ACE2FAAH
SCHEMBL11792806 0.81 GPR84 (0.50) GPR84FFAR4FFAR1ACE2FAAH
SCHEMBL11799508 0.80 GPR84 (0.49) GPR84FFAR4FFAR1ACE2FAAH
SCHEMBL11603929 0.79 FFAR4 (0.43) GPR84FFAR4FFAR1FAAHNFKB1
SCHEMBL11603619 0.78 FFAR1 (0.44) GPR84FFAR4FFAR1FAAHNFKB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4091107-A RENAL VASODILATORS, ANTICLOTTING AGENTS, GROWTH HORMONE RELEASE, REGULATORS OF IMMUNE RESPONSE MERCK & CO., INC. (US) 1978-05-23 — — US disclosed
US-4033996-A RENAL VASODILATORS, ANTITHROMBOSIS, GROWTH HORMONE RELEASING MERCK & CO., INC. (US) 1977-07-05 — — US disclosed
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