SCHEMBL9730454

SCHEMBL9730454

CCCCCCCCCCCCCCC([C](CCCCCCCCCCCCC)CC(C)C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.36
SPHK1 Q9NYA1 1/20 0.35
LMNA P02545 3/20 0.34
HSPD1 P10809 1/20 0.34
BLM P54132 1/20 0.34
HSPE1 P61604 1/20 0.34
GPR84 Q9NQS5 4/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
CA2 P00918 1/20 0.33
MMP2 P08253 3/20 0.33
MMP3 P08254 3/20 0.33
MMP1 P03956 2/20 0.33
MMP7 P09237 1/20 0.33

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
SCHEMBL10637009 0.82 LMNA (0.43) FFAR4FFAR1SPHK1LMNAGPR84
SCHEMBL7438751 0.75 CES2 (0.41) FFAR4FFAR1LMNAGPR84MEN1
SCHEMBL7440935 0.73 CES2 (0.39) FFAR4FFAR1LMNAGPR84MEN1
SCHEMBL5014639 0.72 CA2 (0.42) FFAR4FFAR1SPHK1LMNAMEN1
SCHEMBL15209687 0.72 CA2 (0.42) FFAR4FFAR1SPHK1LMNAMEN1
SCHEMBL8195637 0.72 CA2 (0.42) FFAR4FFAR1SPHK1LMNAMEN1
SCHEMBL18301373 0.71 LMNA (0.43) FFAR1SPHK1LMNAHSPD1BLM
SCHEMBL11067651 0.71 LMNA (0.43) FFAR1SPHK1LMNAHSPD1BLM
SCHEMBL23498813 0.71 CA2 (0.48) FFAR4FFAR1LMNAGPR84MEN1
SCHEMBL16702733 0.71 CA2 (0.48) FFAR4FFAR1LMNAGPR84MEN1

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
US-5120738-A Cardiovascular disorders FUJIREBIO INC. (JP) 1992-06-09 US disclosed