SCHEMBL30599682

SCHEMBL30599682

CC(C)(S)C(=O)O.CC(C)(S)C(=O)O.CC(C)(S)C(=O)O.CCCCCCCC(O)O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.52
FFAR1 O14842 2/20 0.52
FFAR4 Q5NUL3 1/20 0.47
MAPT P10636 1/20 0.46
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
CA2 P00918 1/20 0.44
HSPD1 P10809 1/20 0.44
BLM P54132 1/20 0.44
HSPE1 P61604 1/20 0.44
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
ACACB O00763 1/20 0.43
ACACA Q13085 1/20 0.43

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
SCHEMBL1171196 1.00 GPR84 (0.52) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL28350728 0.90 GPR84 (0.48) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL28510011 0.86 GPR84 (0.48) GPR84FFAR1FFAR4MAPTLCK
SCHEMBL1171817 0.84 CHRM1 (0.41) GPR84FFAR1MAPTCA2GRIK1
Bicarbonate SCHEMBL28559081 0.83 GPR84 (0.64) GPR84FFAR1FFAR4MAPTLCK
Acetic Acid SCHEMBL11782327 0.81 GPR84 (0.61) GPR84FFAR1FFAR4MAPTLCK
Acetic Acid SCHEMBL28935333 0.81 GPR84 (0.61) GPR84FFAR1FFAR4MAPTLCK
Acetic Acid SCHEMBL21598300 0.81 GPR84 (0.61) GPR84FFAR1FFAR4MAPTLCK
Acetic Acid SCHEMBL11781078 0.81 GPR84 (0.61) GPR84FFAR1FFAR4MAPTLCK
Bicarbonate SCHEMBL154438 0.81 GPR84 (0.60) GPR84FFAR1FFAR4MAPTLCK

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-117136175-A Recess filling material kit, cured product thereof, and recess filling method 株式会社力森诺科 2023-11-28 CN disclosed
CN-116917249-A Recess filling material kit, cured product thereof, and recess filling method 株式会社力森诺科 2023-10-20 CN disclosed