SCHEMBL4733028

SCHEMBL4733028

CCCCCC(CCCCC)(CCCCC)C(=O)C(C(=O)O)C(O)(CC(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.54
BLM P54132 1/20 0.54
HSPE1 P61604 1/20 0.54
CPT2 P23786 2/20 0.42
ACLY P53396 1/20 0.42
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
RECQL P46063 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
FFAR1 O14842 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
AKR1B1 P15121 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GPR84 Q9NQS5 4/20 0.32
GGPS1 O95749 1/20 0.32
FDPS P14324 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32

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
SCHEMBL4732561 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL4733192 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL2404822 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL4730427 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL4731915 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL4728896 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL4728390 0.98 HSPD1 (0.56) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL632608 0.95 HSPD1 (0.51) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL4731893 0.89 HSPD1 (0.46) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL2406240 0.82 CPT2 (0.48) HSPD1BLMHSPE1CPT2ACLY

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
WO-2008043654-A2 BLOND CLEAR TREATMENT HENKEL AG & CO. KGAA (DE) 2008-04-17 WO disclosed