SCHEMBL28184366

SCHEMBL28184366

CCCCCCCC(CC(=O)O)C(C)(C)C

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.58
MMP2 P08253 5/20 0.51
MMP3 P08254 5/20 0.51
MMP1 P03956 3/20 0.51
MMP7 P09237 1/20 0.51
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
FDPS P14324 1/20 0.46
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
S1PR2 O95136 1/20 0.44
S1PR1 P21453 1/20 0.44
HSPD1 P10809 1/20 0.44
BLM P54132 1/20 0.44
HSPE1 P61604 1/20 0.44

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
SCHEMBL28184417 0.98 GPR84 (0.55) GPR84MMP2MMP3MMP1MMP7
SCHEMBL20222989 0.92 GPR84 (0.47) GPR84MMP2MMP3MMP1MMP7
SCHEMBL20222968 0.92 GPR84 (0.47) GPR84MMP2MMP3MMP1MMP7
SCHEMBL27449764 0.91 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL11786725 0.85 GPR84 (0.55) GPR84MMP2MMP3MMP1MMP7
SCHEMBL28464034 0.85 GPR84 (0.55) GPR84MMP2MMP3MMP1MMP7
Water SCHEMBL17947894 0.84 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
Water SCHEMBL9000215 0.84 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
Hydrochloric Acid SCHEMBL11784223 0.84 GPR84 (0.53) GPR84MMP2MMP3MMP1MMP7
SCHEMBL15554136 0.84 HDAC1 (0.41) GPR84MMP2MMP3MMP1MMP7

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
CN-104755510-B Ziegler natta catalyst system of internal donor and preparation method thereof is used as comprising 1,2 phenylene diester 印度石油有限公司 2017-11-07 CN disclosed