SCHEMBL8418771

SCHEMBL8418771

CCCCCCCCC(CCCCCCCC)CCC(=O)C(O)(CC(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.50
BLM P54132 1/20 0.50
HSPE1 P61604 1/20 0.50
FFAR4 Q5NUL3 1/20 0.42
FFAR1 O14842 1/20 0.42
MAPT P10636 1/20 0.41
HDAC11 Q96DB2 3/20 0.40
HDAC3 O15379 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
GPR84 Q9NQS5 6/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40

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
SCHEMBL8417215 1.00 HSPD1 (0.50) HSPD1BLMHSPE1FFAR4FFAR1
SCHEMBL28005811 0.84 GPR84 (0.52) FFAR4FFAR1HDAC11GPR84MEN1
SCHEMBL9243129 0.84 GPR84 (0.52) FFAR4FFAR1HDAC11GPR84MEN1
SCHEMBL9238398 0.84 GPR84 (0.52) FFAR4FFAR1HDAC11GPR84MEN1
SCHEMBL8416083 0.76 HSPD1 (0.54) HSPD1BLMHSPE1FFAR4FFAR1
SCHEMBL8417462 0.76 HSPD1 (0.54) HSPD1BLMHSPE1FFAR4FFAR1
SCHEMBL21694571 0.76 FFAR4 (0.62) FFAR4FFAR1MAPTHDAC11GPR84
SCHEMBL15687730 0.76 FFAR4 (0.62) FFAR4FFAR1MAPTHDAC11GPR84
SCHEMBL21955714 0.76 FFAR4 (0.62) FFAR4FFAR1MAPTHDAC11GPR84
SCHEMBL21249767 0.76 FFAR4 (0.62) FFAR4FFAR1MAPTHDAC11GPR84

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
EP-0596811-B1 Molded PVC medical device TERUMO CORP (JP) 1999-09-15 EP claimed