SCHEMBL27969438

SCHEMBL27969438

CCCCCCCCCCCCCCCC(OCCCCCCCCCCCC)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
FAAH O00519 1/20 0.44
TSHR P16473 2/20 0.43
PLA2G2C Q5R387 1/20 0.42
GPR84 Q9NQS5 5/20 0.42
NAAA Q02083 1/20 0.42
FFAR1 O14842 1/20 0.42
ZDHHC7 Q9NXF8 1/20 0.42
MAPT P10636 1/20 0.41
DNM1 Q05193 1/20 0.41
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 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
SCHEMBL26386520 1.00 CES2 (0.46) CES2FAAHTSHRPLA2G2CGPR84
SCHEMBL26386523 1.00 CES2 (0.46) CES2FAAHTSHRPLA2G2CGPR84
SCHEMBL7174572 1.00 CES2 (0.46) CES2FAAHTSHRPLA2G2CGPR84
SCHEMBL26386518 0.96 PLA2G2C (0.46) CES2FAAHTSHRPLA2G2CNAAA
SCHEMBL26386524 0.96 PLA2G2C (0.46) CES2FAAHTSHRPLA2G2CNAAA
SCHEMBL27677935 0.94 PLA2G2C (0.44) CES2FAAHTSHRPLA2G2CNAAA
SCHEMBL1723717 0.85 GPR84 (0.52) GPR84NAAAFFAR1MAPTLCK
SCHEMBL2471964 0.85 GPR84 (0.52) GPR84NAAAFFAR1MAPTLCK
SCHEMBL11689463 0.85 GPR84 (0.52) GPR84NAAAFFAR1MAPTLCK
SCHEMBL11768537 0.85 GPR84 (0.52) GPR84NAAAFFAR1MAPTLCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104086392-A Catalytic synthesis method for biphenylacetic acid UNIV YICHUN 2014-10-08 CN claimed
CN-103833089-A Preparation method of pillared composite decontaminating agent CHINESE PEOPLES ARMED POLICE FORCE ACADEMY 2014-06-04 CN claimed
CN-104086392-A Catalytic synthesis method for biphenylacetic acid UNIV YICHUN 2014-10-08 CN disclosed
CN-103833089-A Preparation method of pillared composite decontaminating agent CHINESE PEOPLES ARMED POLICE FORCE ACADEMY 2014-06-04 CN disclosed