Alcohol

Alcohol

SCHEMBL6836573

CCO.CNC(=O)c1ccccc1N(C)C

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
GAA P10253 2/20 0.56
ALDH1A1 P00352 2/20 0.56
TSHR P16473 2/20 0.56
TP53 P04637 1/20 0.56
MAPT P10636 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
PLK1 P53350 1/20 0.46
BRD4 O60885 2/20 0.43
HDAC3 O15379 1/20 0.42
KMT2A Q03164 3/20 0.42
CNR2 P34972 2/20 0.41
PTGS1 P23219 1/20 0.41
MEN1 O00255 2/20 0.40
KAT2B Q92831 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40
BRD2 P25440 1/20 0.40
BRD3 Q15059 1/20 0.40
BRDT Q58F21 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ADRA1D P25100 1/20 0.40

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
SCHEMBL7446834 0.93 GAA (0.64) GAAALDH1A1TSHRTP53MAPT
SCHEMBL26423792 0.83 GAA (0.49) GAAALDH1A1TSHRTP53MAPT
SCHEMBL2486331 0.81 TSHR (0.58) GAAALDH1A1TSHRTP53MAPT
SCHEMBL26444538 0.81 GAA (0.50) GAAALDH1A1TSHRTP53MAPT
SCHEMBL962276 0.80 ALDH1A1 (0.62) GAAALDH1A1TSHRTP53MAPT
Alcohol SCHEMBL19614806 0.80 ALDH1A1 (0.62) GAAALDH1A1TSHRTP53MAPT
SCHEMBL21590264 0.80 GAA (0.44) GAAALDH1A1TSHRTP53MAPT
SCHEMBL28002176 0.78 GAA (0.64) GAAALDH1A1TSHRTP53MAPT
SCHEMBL2484487 0.78 TSHR (0.57) GAAALDH1A1TSHRTP53MAPT
SCHEMBL21590254 0.78 GAA (0.42) GAAALDH1A1TSHRTP53MAPT

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-20040082774-A1 Novel phosphate and thiophosphate protecting groups ISIS PHARMACEUTICALS, INC. 2004-04-29 US disclosed
US-6610837-B1 Preparation of an oligonucleotide compound of given formula by reacting with given compounds, followed by oxidation or sulfurization ISIS PHARMACEUTICALS, INC. 2003-08-26 US disclosed
US-6121437-A SYNTHESIS OF OLIGONUCLEOTIDES USING OLIGONUCLEOTIDES OR NUCLEOTIDES WITH PROTECTED INTERNUCLEOSIDIC PHOSPHORUS FUNCTIONALITIES WHICH CAN BE REMOVED UNDER MILD CONDITIONS AND PRODUCE NONTOXIC BY-PRODUCTS ISIS PHARMACEUTICALS, INC. (US) 2000-09-19 US 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-20040082774-A1 Novel phosphate and thiophosphate protecting groups TYMP, MTAP, PPIP5K2 GAA 1448/4885ALDH1A1 4612/4885TSHR 3188/4885

“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.