SCHEMBL8071827

SCHEMBL8071827

CCCCCCCCCCC(C)N(C)CC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.47
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
MAPT P10636 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42

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
SCHEMBL21931632 1.00 GPR84 (0.47) GPR84FFAR1FFAR4ACE2MAPT
SCHEMBL5983947 0.98 GPR84 (0.44) GPR84FFAR1FFAR4ACE2
SCHEMBL5983944 0.98 GPR84 (0.44) GPR84FFAR1FFAR4ACE2
SCHEMBL21931638 0.91 PPARG (0.51) FFAR1FFAR4MAPTPPARDALDH1A1
SCHEMBL5606209 0.83 GPR84 (0.48) GPR84FFAR1FFAR4ACE2MAPT
SCHEMBL21931647 0.83 GPR84 (0.48) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL26999624 0.83 GPR84 (0.48) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL10577135 0.83 GPR84 (0.48) GPR84FFAR1FFAR4ACE2MAPT
SCHEMBL11867096 0.82 FFAR4 (0.51) GPR84FFAR1FFAR4PPARDALDH1A1
SCHEMBL20471673 0.82 GPR84 (0.44) GPR84FFAR1FFAR4ACE2MAPT

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
EP-1023466-A2 MICROORGANISM GENOMICS, COMPOSITIONS AND METHODS RELATED THERETO WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2000-08-02 EP disclosed
WO-1999020799-A2 MICROORGANISM GENOMICS, COMPOSITIONS AND METHODS RELATED THERETO WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-04-29 WO disclosed