Alcohol

Alcohol

SCHEMBL3626014

CCO.C[C@H](OC(=O)c1ccccc1C(=O)O)c1ccccc1C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
TAS2R14 Q9NYV8 2/20 0.40
CNR2 P34972 1/20 0.40
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
RBP4 P02753 1/20 0.39
SCN1A P35498 1/20 0.38
SCN2A Q99250 1/20 0.38
SCN3A Q9NY46 1/20 0.38
ACP3 P15309 1/20 0.37
PPARG P37231 2/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.36
RECQL P46063 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
Alcohol SCHEMBL3631205 1.00 ALDH1A1 (0.47) ALDH1A1TAS2R14CNR2HPGDSMN1; SMN2
SCHEMBL12021827 0.95 ALDH1A1 (0.45) ALDH1A1TAS2R14CNR2HPGDSMN1; SMN2
SCHEMBL3626019 0.95 ALDH1A1 (0.45) ALDH1A1TAS2R14CNR2HPGDSMN1; SMN2
SCHEMBL3631209 0.95 ALDH1A1 (0.45) ALDH1A1TAS2R14CNR2HPGDSMN1; SMN2
Alcohol SCHEMBL3628209 0.83 ALDH1A1 (0.50) ALDH1A1SCN1ASCN2ASCN3AKMT2A
Alcohol SCHEMBL3628326 0.83 ALDH1A1 (0.50) ALDH1A1SCN1ASCN2ASCN3AKMT2A
SCHEMBL12021900 0.77 ALDH1A1 (0.48) ALDH1A1HPGDKDM4E
SCHEMBL3628328 0.77 ALDH1A1 (0.48) ALDH1A1HPGDKDM4E
SCHEMBL3628211 0.77 ALDH1A1 (0.48) ALDH1A1HPGDKDM4E
Phthalic Acid SCHEMBL3626025 0.77 TAS2R14 (0.48) ALDH1A1TAS2R14CNR2ACP3KMT2A

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 47/4885TAS2R14 4123/4885CNR2 3480/4885

“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.