SCHEMBL6460737

SCHEMBL6460737

COc1ccc(CCC(O)CC(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 9/20 0.65
MMP13 P45452 7/20 0.65
MMP2 P08253 1/20 0.62
MMP9 P14780 1/20 0.62
MMP14 P50281 1/20 0.62
PTGFR P43088 1/20 0.52
LDHA P00338 1/20 0.51
FFAR1 O14842 3/20 0.51
ALDH1A1 P00352 1/20 0.51
F2RL1 P55085 1/20 0.50
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL5613430 0.95 MMP12 (0.72) MMP12MMP13MMP2MMP9MMP14
SCHEMBL28009962 0.91 MMP12 (0.55) MMP12MMP13MMP2MMP9MMP14
SCHEMBL11221992 0.85 LDHA (0.53) MMP12MMP13MMP2MMP9LDHA
SCHEMBL7277594 0.84 HTT (0.56) PTGFRALDH1A1F2RL1
SCHEMBL6462909 0.83 LDHA (0.64) MMP2MMP9LDHAFFAR1POLB
SCHEMBL5365699 0.83 S1PR2 (0.62) MMP12MMP2MMP9LDHAFFAR1
SCHEMBL6462808 0.83 FFAR1 (0.50) MMP12MMP13MMP2MMP9LDHA
SCHEMBL6464896 0.83 FFAR1 (0.50) MMP12MMP13MMP2MMP9LDHA
SCHEMBL5613402 0.83 MMP12 (0.91) MMP12MMP13MMP2MMP9MMP14
SCHEMBL1139059 0.81 MMP12 (0.68) MMP12MMP13MMP2MMP9MMP14

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 MMP12 132/4885MMP13 49/4885MMP2 566/4885

“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.