SCHEMBL27780263

SCHEMBL27780263

CCC(C)CCCCCCCCCCCCCCCCCCCCCC(O)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.67
FFAR1 O14842 1/20 0.67
ACE2 Q9BYF1 1/20 0.50
TET2 Q6N021 3/20 0.41
KDM4A O75164 2/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM2A Q9Y2K7 2/20 0.41
TET3 O43151 1/20 0.41
TBXAS1 P24557 2/20 0.40
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39

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
SCHEMBL27786175 0.86 GPR84 (0.84) GPR84FFAR1ACE2MAPTLCK
SCHEMBL8044971 0.86 GPR84 (0.84) GPR84FFAR1ACE2MAPTLCK
SCHEMBL14662505 0.85 GPR84 (0.50) GPR84FFAR1ACE2TET2KDM4A
SCHEMBL14661753 0.85 GPR84 (0.50) GPR84FFAR1ACE2TET2KDM4A
SCHEMBL3646244 0.85 GPR84 (0.50) GPR84FFAR1ACE2TET2KDM4A
SCHEMBL14661754 0.85 GPR84 (0.50) GPR84FFAR1ACE2TET2KDM4A
SCHEMBL14661581 0.85 GPR84 (0.50) GPR84FFAR1ACE2TET2KDM4A
SCHEMBL14661321 0.85 GPR84 (0.50) GPR84FFAR1ACE2TET2KDM4A
SCHEMBL5696751 0.82 GPR84 (0.76) GPR84FFAR1TET2KDM4AKDM4C
Ethylene Glycol SCHEMBL27810054 0.81 GPR84 (0.75) GPR84FFAR1ACE2MAPTLCK

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
CN-101646643-B Method for producing cross-coupled compound KAO CORP 2013-06-05 CN disclosed
CN-101646643-A Method for producing cross-coupled compound KAO CORP JP 2010-02-10 CN disclosed