SCHEMBL8159103

SCHEMBL8159103

COC(=O)C(CC(C)C)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.62
RNPEP Q9H4A4 1/20 0.44
SLC7A5 Q01650 1/20 0.44
ALDH1A1 P00352 2/20 0.43
FOLH1 Q04609 1/20 0.42
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
CPA1 P15085 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL1059738 0.90 MME (0.56) MMERNPEPSLC7A5ALDH1A1FOLH1
SCHEMBL27499466 0.86 MME (0.53) MMERNPEPSLC7A5ALDH1A1FOLH1
SCHEMBL28741357 0.85 MME (0.47) MMEFOLH1KMT2ASMN1; SMN2
SCHEMBL4135108 0.84 MME (0.51) MMEALDH1A1FOLH1SMN1; SMN2TAS1R3
SCHEMBL6896224 0.82 MME (0.50) MMESLC7A5FOLH1SMN1; SMN2TAS1R3
SCHEMBL6896219 0.82 MME (0.50) MMESLC7A5FOLH1SMN1; SMN2TAS1R3
SCHEMBL5143577 0.80 MME (0.49) MMEFOLH1SMN1; SMN2TAS1R3TAS1R1
SCHEMBL8166210 0.80 MME (0.49) MMEALDH1A1FOLH1SMN1; SMN2TAS1R3
SCHEMBL1458577 0.80 MME (0.49) MMEALDH1A1LMNASMN1; SMN2TAS1R3
SCHEMBL489304 0.79 MME (0.43) MMERNPEPSLC7A5ALDH1A1LMNA

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
EP-0994905-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 2000-04-26 EP disclosed
WO-1999057160-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY B.V. (NL) 1999-11-11 WO disclosed