Octanol

Octanol

SCHEMBL492895

CCCCCCCCO.CCOC(C)=O

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
ALDH1A1 P00352 3/20 0.61
HSD17B10 Q99714 2/20 0.61
TSHR P16473 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.52
CYP4F2 P78329 2/20 0.48
CYP4A11 Q02928 2/20 0.48
FAAH O00519 1/20 0.47
ACHE P22303 6/20 0.46
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 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
1-Heptanol SCHEMBL2461694 1.00 LMNA (0.61) LMNAALDH1A1HSD17B10TSHRMEN1
Nonanol SCHEMBL10363769 1.00 LMNA (0.61) LMNAALDH1A1HSD17B10TSHRMEN1
1-Hexanol SCHEMBL537293 1.00 LMNA (0.61) LMNAALDH1A1HSD17B10TSHRMEN1
Cetyl Alcohol SCHEMBL7713541 1.00 LMNA (0.61) LMNAALDH1A1HSD17B10TSHRMEN1
1-Hexanol SCHEMBL20395883 0.98 ALDH1A1 (0.58) LMNAALDH1A1HSD17B10TSHRMEN1
1-Pentanol SCHEMBL3390919 0.98 ALDH1A1 (0.64) LMNAALDH1A1HSD17B10TSHRMEN1
Heptane SCHEMBL10663246 0.96 ALDH1A1 (0.61) LMNAALDH1A1HSD17B10TSHRMEN1
1-Heptanol SCHEMBL8548655 0.94 LMNA (0.54) LMNAALDH1A1HSD17B10TSHRMEN1
1-Pentanol SCHEMBL28324770 0.94 ALDH1A1 (0.58) LMNAALDH1A1HSD17B10TSHRMEN1
Hexane SCHEMBL5393958 0.93 ALDH1A1 (0.64) LMNAALDH1A1HSD17B10TSHRMEN1

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023135259-A1 SEMI-INTEGRATED METHOD FOR ENZYME-ASSISTED EXTRACTION AND PURIFICATION OF P-HYDROXYCINNAMIC ACIDS INSTITUT NATIONAL DES SCIENCES ET INDUSTRIES DU VIVANT ET DE L'ENVIRONNEMENT (AGROPARISTECH) (FR) 2023-07-20 WO disclosed
US-11117884-B2 Potent gamma-secretase modulators THE GENERAL HOSPITAL CORPORATION (US) 2021-09-14 US disclosed
CN-107406423-B Potent gamma-secretase modulators 通用医疗公司 2020-06-16 CN disclosed
US-20200055840-A1 POTENT GAMMA-SECRETASE MODULATORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-20 US disclosed
US-10472346-B2 Potent gamma-secretase modulators THE GENERAL HOSPITAL CORPORATION (US) 2019-11-12 US disclosed
US-10408819-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity PROMEGA CORPORATION (US) 2019-09-10 US disclosed
US-20180093967-A1 POTENT GAMMA-SECRETASE MODULATORS THE GENERAL HOSPITAL CORPORATION 2018-04-05 US disclosed
CN-107406423-A Potent gamma secretase modulators 通用医疗公司 2017-11-28 CN disclosed
EP-3212633-A1 POTENT GAMMA-SECRETASE MODULATORS The General Hospital Corporation (US) 2017-09-06 EP disclosed
US-20170191985-A1 LUMINESCENCE-BASED METHODS AND PROBES FOR MEASURING CYTOCHROME P450 ACTIVITY JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-07-06 US disclosed
US-6172061-B1 AIDS THERAPY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-01-09 US disclosed
US-6166006-A Anilide derivative, production and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-12-26 US disclosed
EP-1040103-A1 ANILIDE DERIVATIVE, PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-10-04 EP disclosed
EP-1039899-A2 PHARMACEUTICAL COMPOSITION FOR ANTAGONIZING CCR5 COMPRISING ANILIDE DERIVATIVE Takeda Chemical Industries, Ltd. (JP) 2000-10-04 EP disclosed
WO-1999032100-A2 PHARMACEUTICAL COMPOSITION FOR ANTAGONIZING CCR5 COMPRISING ANILIDE DERIVATIVE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-01 WO disclosed
WO-1999032468-A1 ANILIDE DERIVATIVE, PRODUCTION AND USE THEREOF TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-01 WO disclosed
EP-0726896-A1 5-ARYLISOXAZOL-4-YL-SUBSTITUTED 2-AMINO CARBOXYLIC ACID COMPOUNDS H. LUNDBECK A/S (DK) 1996-08-21 EP disclosed
WO-1995012587-A1 5-ARYLISOXAZOL-4-YL-SUBSTITUTED 2-AMINO CARBOXYLIC ACID COMPOUNDS H. LUNDBECK A/S (DK) 1995-05-11 WO disclosed
EP-0535192-A1 NOVEL DNA GYRASE INHIBITORS, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL PREPARATIONS CONTAINING SAME. HOFFMANN LA ROCHE (CH) 1993-04-07 EP disclosed
US-4826851-A 2-substituted ergoline urea and thio-urea derivatives having neurolyptic/dopaminergic activity SCHERING AKTIENGESELLSCHAFT (DE) 1989-05-02 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 (5 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-20200055840-A1 POTENT GAMMA-SECRETASE MODULATORS BACE1, BACE2, GSAP LMNA 2265/4885ALDH1A1 2818/4885HSD17B10 2261/4885
US-10472346-B2 Potent gamma-secretase modulators BACE1, BACE2, APP LMNA 694/4885ALDH1A1 2207/4885HSD17B10 1055/4885
US-11117884-B2 Potent gamma-secretase modulators BACE1, BACE2, GSAP LMNA 2265/4885ALDH1A1 2818/4885HSD17B10 2261/4885
US-10408819-B2 Luminescence-based methods and probes for measuring cytochrome P450 activity CYP3A7, CYP3A43, CYP3A5 LMNA 696/4885ALDH1A1 309/4885HSD17B10 528/4885
US-20180093967-A1 POTENT GAMMA-SECRETASE MODULATORS BACE1, BACE2, APP LMNA 694/4885ALDH1A1 2207/4885HSD17B10 1055/4885

“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.