SCHEMBL5606729

SCHEMBL5606729

CCCCC(=Cc1ccc(O)cc1)C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.50
HSD17B3 P37058 7/20 0.46
ABCG2 Q9UNQ0 3/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
TYR P14679 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALOX5 P09917 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL5607349 0.91 CA12 (0.44) MIFHSD17B3ABCG2CA12CA1
SCHEMBL5607413 0.87 MIF (0.49) MIFHSD17B3CA12CA1CA2
SCHEMBL6062333 0.85 MIF (0.48) MIFHSD17B3ABCG2CA12CA1
SCHEMBL5607546 0.85 ESR1 (0.51) MIFHSD17B3ABCG2CA12CA1
SCHEMBL10924807 0.84 MIF (0.49) MIFHSD17B3ABCG2ALOX5KDM4E
SCHEMBL5607567 0.84 MIF (0.47) MIFHSD17B3ABCG2CA12CA1
SCHEMBL5606981 0.84 ESR1 (0.47) MIFABCG2CA12CA1CA2
SCHEMBL29741641 0.83 ALOX5 (0.52) MIFHSD17B3ALOX5KDM4EALDH1A1
SCHEMBL5607169 0.83 ALOX5 (0.52) MIFHSD17B3ALOX5KDM4EALDH1A1
SCHEMBL2187658 0.82 LMNA (0.55) ALOX5

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-20070142472-A1 Process for producing optically active 3-(4-hydroxyphenyl)proprionic acids TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-06-21 US disclosed
EP-1687250-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 3-(4-HYDROXYPHENYL)PROPIONIC ACIDS Takasago International Corporation (JP) 2006-08-09 EP disclosed
WO-2005051882-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 3-(4-HYDROXYPHENYL)PROPIONIC ACIDS TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-09 WO 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-20070142472-A1 Process for producing optically active 3-(4-hydroxyphenyl)proprionic acids ALDH1A2, ALDH1A3, GRHPR MIF 2713/4885HSD17B3 287/4885ABCG2 3631/4885

“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.