Alcohol

Alcohol

SCHEMBL21724016

CC(=O)N(C)C.CCO.[CH2][CH]C

nearest known ligand 0.32

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 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 4/20 0.32
CHRM1 P11229 2/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM3 P20309 1/20 0.30
THPO P40225 1/20 0.30

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 SCHEMBL7320295 0.86
Alcohol SCHEMBL10569458 0.83 ALDH1A1 (0.40) ALDH1A1TDP1TSHRCHRM1CHRM2
Dimethylformamide SCHEMBL28282130 0.79 TSHR (0.47) ALDH1A1TDP1TSHRCHRM1CHRM2
Propane SCHEMBL27404624 0.76
Ethylene Glycol SCHEMBL7033601 0.74 ALDH1A1 (0.39) ALDH1A1TDP1TSHRCHRM1CHRM2
SCHEMBL28333523 0.73
Ethylene SCHEMBL18836924 0.73
SCHEMBL1332099 0.72
SCHEMBL1925147 0.72 ALDH1A1 (0.50) ALDH1A1TDP1TSHRCHRM1CHRM2
SCHEMBL30581185 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999715-B2 ASK1 inhibiting agents BIOGEN MA INC. (US) 2024-06-04 US disclosed
US-20240109867-A1 ASK1 INHIBITING AGENTS BIOGEN MA INC. 2024-04-04 US disclosed
US-11897898-B2 Pyridine macrocycle compounds as ASK1 inhibiting agents BIOGEN MA INC. (US) 2024-02-13 US disclosed
US-11814362-B2 ASK1 inhibiting agents BIOGEN MA INC. (US) 2023-11-14 US disclosed
EP-3837251-B1 ASK1 INHIBITING AGENTS BIOGEN MA INC (US) 2023-06-21 EP disclosed
EP-3837265-B1 PYRIDINE MACROCYCLE COMPOUNDS AS ASK1 INHIBITING AGENTS BIOGEN MA INC (US) 2023-02-22 EP disclosed
US-20210317103-A1 ASK1 INHIBITING AGENTS BIOGEN MA INC. 2021-10-14 US disclosed
US-20210300946-A1 PYRIDINE MACROCYCLE COMPOUNDS AS ASK1 INHIBITING AGENTS BIOGEN MA INC. 2021-09-30 US disclosed
EP-3837251-A1 ASK1 INHIBITING AGENTS Biogen MA Inc. (US) 2021-06-23 EP disclosed
EP-3837265-A1 PYRIDINE MACROCYCLE COMPOUNDS AS ASK1 INHIBITING AGENTS Biogen MA Inc. (US) 2021-06-23 EP disclosed
US-20210115020-A1 ASK1 INHIBITING AGENTS BIOGEN MA INC. 2021-04-22 US disclosed
WO-2020036946-A1 PYRIDINE MACROCYCLE COMPOUNDS AS ASK1 INHIBITING AGENTS BIOGEN MA INC. (US) 2020-02-20 WO disclosed
WO-2020036949-A1 ASK1 INHIBITING AGENTS BIOGEN MA INC. (US) 2020-02-20 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 (7 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-20210317103-A1 ASK1 INHIBITING AGENTS MAP3K1, MAP3K6, MAP3K10 ALDH1A1 2482/4885TDP1 148/4885TSHR 2691/4885
US-11897898-B2 Pyridine macrocycle compounds as ASK1 inhibiting agents MAP3K1, MAP3K19, MAP3K20 ALDH1A1 2878/4885TDP1 291/4885TSHR 2621/4885
US-20210115020-A1 ASK1 INHIBITING AGENTS MAP3K1, MAP3K10, MAP3K20 ALDH1A1 2661/4885TDP1 189/4885TSHR 2807/4885
US-20210300946-A1 PYRIDINE MACROCYCLE COMPOUNDS AS ASK1 INHIBITING AGENTS MAP3K1, MAP3K19, MAP3K20 ALDH1A1 2878/4885TDP1 291/4885TSHR 2621/4885
US-11999715-B2 ASK1 inhibiting agents MAP3K1, MAP3K6, MAP3K10 ALDH1A1 2482/4885TDP1 148/4885TSHR 2691/4885
US-11814362-B2 ASK1 inhibiting agents MAP3K1, MAP3K10, MAP3K20 ALDH1A1 2661/4885TDP1 189/4885TSHR 2807/4885
US-20240109867-A1 ASK1 INHIBITING AGENTS MAP3K1, MAP3K10, MAP3K20 ALDH1A1 2661/4885TDP1 189/4885TSHR 2807/4885

“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.