SCHEMBL3628696

SCHEMBL3628696

O=C(O)c1ccccc1C(=O)OCc1ccccc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
IDO1 P14902 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
MAOB P27338 2/20 0.47
MAOA P21397 1/20 0.47
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
TGM2 P21980 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
POLQ O75417 1/20 0.43
SGMS2 Q8NHU3 1/20 0.42
FABP3 P05413 1/20 0.42
FABP4 P15090 1/20 0.42
EPHX2 P34913 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
TAS2R14 Q9NYV8 2/20 0.42

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
Alcohol SCHEMBL3628691 0.95 ALDH1A1 (0.52) ALDH1A1IDO1L3MBTL1MAOBMAOA
SCHEMBL27719473 0.94 IDO1 (0.54) ALDH1A1IDO1L3MBTL1MAOBMAOA
SCHEMBL28084232 0.84 ALDH1A1 (0.73) ALDH1A1L3MBTL1PPARGKDM4ELMNA
Phthalic Acid SCHEMBL3628700 0.81 ALDH1A1 (0.50) ALDH1A1IDO1L3MBTL1PPARGPPARA
SCHEMBL3628202 0.80 ALDH1A1 (0.63) ALDH1A1L3MBTL1KDM4ELMNATDP1
SCHEMBL29629421 0.79 ALDH1A1 (0.62) ALDH1A1IDO1MAOBMAOAKDM4E
SCHEMBL5839903 0.79 ALDH1A1 (0.62) ALDH1A1IDO1MAOBMAOAKDM4E
SCHEMBL5932728 0.78 IDO1 (0.58) ALDH1A1IDO1MAOBMAOAPPARG
SCHEMBL8567872 0.78 ALDH1A1 (0.59) ALDH1A1L3MBTL1KDM4ETDP1
SCHEMBL16127475 0.77 ALDH1A1 (0.63) ALDH1A1L3MBTL1KDM4ELMNATDP1

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
EP-1935866-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE FLUOROBENZYL ALCOHOL CENTRAL GLASS CO LTD (JP) 2011-12-14 EP disclosed
US-7795478-B2 Process for producing optically active fluorobenzyl alcohol CENTRAL GLASS COMPANY, LIMITED (JP) 2010-09-14 US disclosed
US-20090240087-A1 Process for Producing Optically Active Fluorobenzyl Alcohol CENTRAL GLASS COMPANY, LIMITED (JP) 2009-09-24 US disclosed
EP-1935866-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE FLUOROBENZYL ALCOHOL Central Glass Company, Limited (JP) 2008-06-25 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-20090240087-A1 Process for Producing Optically Active Fluorobenzyl Alcohol ADH1A, ADH1C, ADH5 ALDH1A1 47/4885IDO1 2555/4885L3MBTL1 3583/4885

“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.