SCHEMBL6465879

SCHEMBL6465879

CC(C)(C)CCC(O)CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.52
GPR84 Q9NQS5 4/20 0.50
MAPT P10636 1/20 0.45
GABRR1 P24046 2/20 0.44
LMNA P02545 1/20 0.44
RIPK1 Q13546 1/20 0.39
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
MMP12 P39900 4/20 0.38
MMP13 P45452 4/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP14 P50281 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
PGD P52209 1/20 0.36

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
SCHEMBL13991523 0.90 SLC22A6 (0.46) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL21654291 0.90 SLC22A6 (0.46) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL26138089 0.83 SLC22A6 (0.75) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL3089526 0.80 SLC22A6 (0.71) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL27544066 0.79 SLC22A6 (0.55) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL9200070 0.77 BHMT (0.43) SLC22A6RIPK1
SCHEMBL8896856 0.77 RIPK1 (0.44) RIPK1ACACBACACA
SCHEMBL16600523 0.76 SLC22A6 (0.57) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL665350 0.76 SLC22A6 (0.57) SLC22A6GPR84MAPTGABRR1LMNA
SCHEMBL597917 0.76 GPR84 (0.59) SLC22A6GPR84MAPTGABRR1LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6903233-B2 Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-07 US disclosed
US-20030225301-A1 Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester TAKASAGO INTERNATIONAL CORPORATION (JP) 2003-12-04 US disclosed
EP-1344763-A1 Process for producing optically active 3-halogenocarboxylic acid esters and 3-azide-carboxylic acid esters Takasago International Corporation (JP) 2003-09-17 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030225301-A1 Process for producing optically active 3-halogenocarboxylic acid ester and 3-azidocarboxylic acid ester HDHD5, APEH, AOC3 SLC22A6 1264/4885GPR84 3209/4885MAPT 4347/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.