SCHEMBL4148459

SCHEMBL4148459

O=C(O)c1ccccc1-c1ccc(OCCC(O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
PTPN11 Q06124 3/20 0.47
FFAR4 Q5NUL3 3/20 0.45
BRS3 P32247 5/20 0.45
KCNH2 Q12809 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
GAA P10253 1/20 0.44
PKM P14618 1/20 0.44
PDE10A Q9Y233 1/20 0.43
MAPK1 P28482 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
LTB4R2 Q9NPC1 2/20 0.43

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
SCHEMBL3297131 0.81 PRKAB2 (0.55) ALDH1A1PTPN11FFAR4BRS3KCNH2
SCHEMBL28247966 0.80 LTB4R2 (0.48) ALDH1A1PTPN11FFAR4BRS3FNTA
SCHEMBL4988323 0.79 NPC1 (0.59) ALDH1A1PTPN11FFAR4LTB4R2
SCHEMBL9723854 0.79 PTPN11 (0.74) ALDH1A1PTPN11
SCHEMBL10800801 0.79 PTPN11 (0.74) ALDH1A1PTPN11
SCHEMBL17835424 0.79 PTPN11 (0.74) ALDH1A1PTPN11
SCHEMBL6265322 0.79 PTPN11 (0.74) ALDH1A1PTPN11
SCHEMBL10397754 0.79 PTPN11 (0.74) ALDH1A1PTPN11
SCHEMBL9407174 0.79 PTPN11 (0.74) ALDH1A1PTPN11
SCHEMBL6913917 0.79 PTPN11 (0.70) ALDH1A1PTPN11LTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090030218-A1 Method For Producing Aminoalcohol Derivative Having Biphenyl Group KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-01-29 US claimed
EP-1932826-A1 METHOD FOR PRODUCING AMINOALCOHOL DERIVATIVE HAVING BIPHENYL GROUP Kissei Pharmaceutical Co., Ltd. (JP) 2008-06-18 EP claimed
US-20090030218-A1 Method For Producing Aminoalcohol Derivative Having Biphenyl Group KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-01-29 US disclosed
EP-1932826-A1 METHOD FOR PRODUCING AMINOALCOHOL DERIVATIVE HAVING BIPHENYL GROUP Kissei Pharmaceutical Co., Ltd. (JP) 2008-06-18 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-20090030218-A1 Method For Producing Aminoalcohol Derivative Having Biphenyl Group ALDH7A1, DDC, ADH5 ALDH1A1 16/4885PTPN11 3466/4885FFAR4 731/4885

“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.