Octanol

Octanol

SCHEMBL374162

CCCCCCCCO.O=C(O)C(F)(F)F

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
HSD17B10 Q99714 2/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
ALDH1A1 P00352 1/20 0.59
TSHR P16473 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.55
FAAH O00519 9/20 0.54
CES1 P23141 6/20 0.54
CES2 O00748 5/20 0.54
CYP1A2 P05177 1/20 0.54
EPHX1 P07099 1/20 0.48

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-Hexanol SCHEMBL7731082 1.00 LMNA (0.59) LMNAHSD17B10MEN1KMT2AALDH1A1
Nonanol SCHEMBL271357 1.00 LMNA (0.59) LMNAHSD17B10MEN1KMT2AALDH1A1
1-Heptanol SCHEMBL22557209 1.00 LMNA (0.59) LMNAHSD17B10MEN1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL28259283 0.93 ALDH1A1 (0.52) LMNAHSD17B10MEN1KMT2AALDH1A1
Trifluoroacetic Acid SCHEMBL5402982 0.91 ALDH1A1 (0.55) LMNAHSD17B10MEN1KMT2AALDH1A1
Heptane SCHEMBL1776021 0.91 FAAH (0.58) HSD17B10MEN1KMT2AALDH1A1TSHR
Trifluoroacetic Acid SCHEMBL28259282 0.91 FAAH (0.54) HSD17B10MEN1KMT2ASMN1; SMN2FAAH
Heptane SCHEMBL3935940 0.91 FAAH (0.62) HSD17B10MEN1KMT2AALDH1A1TSHR
Nonane SCHEMBL4255344 0.91 FAAH (0.62) HSD17B10MEN1KMT2AALDH1A1TSHR
Hexadecane SCHEMBL4765353 0.91 FAAH (0.62) HSD17B10MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240132519-A1 NRF2-ACTIVATING COMPOUND SENJU PHARMACEUTICAL CO., LTD. (JP) 2024-04-25 US claimed
EP-4273145-A1 NRF2-ACTIVATING COMPOUND Senju Pharmaceutical Co., Ltd. (JP) 2023-11-08 EP claimed
CN-116669744-A Nrf2 activating compounds 千寿制药株式会社 2023-08-29 CN claimed
CN-116500167-A Method for separating and detecting enantiomer and diastereoisomer of baluo Sha Weizhi 常州英诺升康生物医药科技有限公司 2023-07-28 CN claimed
CN-107941970-B Separation and detection method of D-p-hydroxyphenylglycine and enantiomer thereof 常州合全药业有限公司 2021-06-08 CN claimed
CN-108624533-B Method for separating and purifying phenyl lactic acid from lactobacillus plantarum 浙江工商大学 2021-03-09 CN claimed
CN-115029329-B Carbonyl reductase mutant and application thereof in preparation of R-mandelic acid 上海瀚鸿科技股份有限公司 2024-06-25 CN disclosed
US-20240132519-A1 NRF2-ACTIVATING COMPOUND SENJU PHARMACEUTICAL CO., LTD. (JP) 2024-04-25 US disclosed
CN-113945672-B Method for detecting ticagrelor and related substances thereof 武汉武药科技有限公司 2024-03-12 CN disclosed
CN-113336636-B Synthesis process of DL-mandelic acid with high yield 湖州柏特生物科技有限公司 2023-11-10 CN disclosed
EP-4273145-A1 NRF2-ACTIVATING COMPOUND Senju Pharmaceutical Co., Ltd. (JP) 2023-11-08 EP disclosed
US-20230323317-A1 NOVEL HYDROLASE AND METHOD FOR PRODUCING (1S,2S)-1-ALKOXYCARBONYL-2-VINYLCYCLOPROPANE CARBOXYLIC ACID USING SAME API CORPORATION (JP) 2023-10-12 US disclosed
CN-116669744-A Nrf2 activating compounds 千寿制药株式会社 2023-08-29 CN disclosed
EP-0832082-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1998-04-01 EP disclosed
WO-1997022591-A1 BENZAZEPINE DERIVATIVES WITH VASOPRESSIN AGONISTIC ACTIVITY OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-06-26 WO disclosed
WO-1997011960-A1 ANTAGONISTS OF ENDOTHELIN RECEPTORS JAPAT LTD. (CH) 1997-04-03 WO disclosed
WO-1996040681-A1 N-HETEROARYL-PYRIDINESULFONAMIDE DERIVATIVES AND THEIR USE AS ENDOTHELIN ANTAGONISTS ZENECA LIMITED (GB) 1996-12-19 WO disclosed
US-5457225-A Process for preparation of 5-hydroxy-3-ketoester derivative and optically active substance thereof UBE INDUSTRIES LTD. (JP) 1995-10-10 US disclosed
US-5434152-A AIDS, enzyme inhibitor MERCK & CO., INC. (US) 1995-07-18 US disclosed
WO-1995013273-A1 ASYMMETRIC SYNTHESIS OF (S)-(-)-6-CHLORO-4-CYCLOPROPYL-3,4-DIHYDRO-4-[(2-PYRIDYL)ETHYNYL]-2(1H)-QUINAZOLINONE MERCK & CO., INC. (US) 1995-05-18 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 (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-20240132519-A1 NRF2-ACTIVATING COMPOUND NFE2L2, KEAP1, NFE2 LMNA 2635/4885HSD17B10 499/4885MEN1 4415/4885

“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.