SCHEMBL11550378

SCHEMBL11550378

CCCCCCCCCCCCCCCCSCCCCCCCCCCCCC(O)C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.78
FFAR1 O14842 2/20 0.78
MAPT P10636 2/20 0.53
GMNN O75496 1/20 0.53
TP53 P04637 1/20 0.53
POLB P06746 1/20 0.53
THRB P10828 1/20 0.53
CYP2C9 P11712 1/20 0.53
BLM P54132 1/20 0.53
HSD17B10 Q99714 1/20 0.53
CES2 O00748 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
FFAR4 Q5NUL3 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
S1PR2 O95136 1/20 0.46
S1PR4 O95977 1/20 0.46
S1PR1 P21453 1/20 0.46

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
SCHEMBL18832138 0.93 GPR84 (0.66) GPR84FFAR1MAPTGMNNTP53
SCHEMBL18832145 0.93 GPR84 (0.66) GPR84FFAR1MAPTGMNNTP53
SCHEMBL18832149 0.93 GPR84 (0.66) GPR84FFAR1MAPTGMNNTP53
SCHEMBL18832143 0.91 GPR84 (0.62) GPR84FFAR1MAPTGMNNTP53
SCHEMBL722785 0.91 GPR84 (0.62) GPR84FFAR1MAPTGMNNTP53
SCHEMBL525619 0.88 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2709599 0.88 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL525377 0.88 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL4757199 0.88 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL524494 0.88 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD

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-4157971-A ALIPHATIC ESTER, PHENYL NAPHTHYLAMINES, PHOSPHATE ESTER, POLYHYDROXY ANTHRAQUINONE, ALKYL THIOACID ESTER TEXACO INC. (US) 1979-06-12 US disclosed