SCHEMBL499108

SCHEMBL499108

C1CCCC(C2CCCCCOO2)CCC1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL1765023 1.00 ALDH1A1 (0.33) ALDH1A1
SCHEMBL14862746 1.00 ALDH1A1 (0.33) ALDH1A1
Water SCHEMBL9834052 0.98 ALDH1A1 (0.32) ALDH1A1
Water SCHEMBL9833095 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL11361884 0.98 ALDH1A1 (0.32) ALDH1A1
SCHEMBL60852 0.95 ALDH1A1 (0.33) ALDH1A1
SCHEMBL7775476 0.92 ALDH1A1 (0.35) ALDH1A1
SCHEMBL27954070 0.87 ALDH1A1 (0.35) ALDH1A1
SCHEMBL11663000 0.87 ALDH1A1 (0.35) ALDH1A1
SCHEMBL5892635 0.86 ALDH1A1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2766352-B1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIV HEALTH NETWORK UHN (CA) 2018-06-06 EP claimed
EP-2766352-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME University Health Network (UHN) (CA) 2014-08-20 EP claimed
US-20140051679-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERISTY HEALTH NETWORKS (CA) 2014-02-20 US claimed
WO-2013053051-A1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIVERSITY HEALTH NETWORK (CA) 2013-04-18 WO claimed
US-5637610-A ANTICHOLESTEROL AGENT SUNTORY LIMITED (JP) 1997-06-10 US claimed
US-5270335-A Administering a dioxabicyclo(3.3.0)octane SUNTORY LIMITED (JP) 1993-12-14 US claimed
US-4684740-A Production of 2,6-bis (4-hydroxy-3,5-dimethoxyphenyl-3,7-dioxabicyclo (3.3.0) octane JUJO PAPER CO., LTD. (JP) 1987-08-04 US claimed
CN-114410604-B Epoxide hydrolase and encoding gene and application thereof 浙江大学 2023-11-14 CN disclosed
US-11466044-B2 Neomycin and paromomycin derivatives WAYNE STATE UNIVERSITY (US) 2022-10-11 US disclosed
US-20210107932-A1 NEOMYCIN AND PAROMOMYCIN DERIVATIVES WAYNE STATE UNIVERSITY (US) 2021-04-15 US disclosed
US-10364196-B2 Multi-functional coating system for cementitious composite materials James Hardie Technology Limited (IE) 2019-07-30 US disclosed
WO-2018187738-A1 NEOMYCIN AND PAROMOMYCIN DERIVATIVES WAYNE STATE UNIVERSITY (US) 2018-10-11 WO disclosed
EP-2766352-B1 INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME UNIV HEALTH NETWORK UHN (CA) 2018-06-06 EP disclosed
EP-0302599-A2 Bicyclo-octane and bicyclo-nonane derivatives, processes for their preparation and their use as herbicides HER MAJESTY THE QUEEN IN RIGHT OF NEW ZEALAND, DEPARTMENT OF SCIENTIFIC AND INDUSTRIAL RESEARCH, CHEMISTRY DIVISON (NZ) 1989-02-08 EP disclosed
EP-0046679-A2 Total synthesis of 1RS,4SR,5RS-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo(3.2.1)octane-1-acetic acid ORTHO PHARMACEUTICAL CORPORATION (US) 1982-03-03 EP disclosed
US-4307019-A Total synthesis of 1RS,4SR,5RS,-4-(4,8-dimethyl-5-hydroxy-7-nonen-1-yl)-4-methyl-3,8-dioxabicyclo[3.2.1]octane-1-acetic acid ORTHO PHARMACEUTICAL CORPORATION (US) 1981-12-22 US disclosed
US-4277401-A MANY STEPS STARTING FROM 1-BROMO-6-METHYL-2-OXO-5-NONEN-9-OIC ACID ORTHO PHARMACEUTICAL CORPORATION (US) 1981-07-07 US disclosed
US-4101527-A Moisture curing polymers prepared from polyfunctional isocyanates and a dioxazabicyclo octane THE SHERWIN-WILLIAMS COMPANY (US) 1978-07-18 US disclosed
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US disclosed
US-3962415-A Insecticide evaporator comprising DDVP with synergized benzodioxole compound as stabilizer AIRWICK INDUSTRIES, INC. (US) 1976-06-08 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 (3 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-11466044-B2 Neomycin and paromomycin derivatives NEK9, NEK5, NEK1 ALDH1A1 4659/4885
US-20140051679-A1 KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME MAP3K7, MAP3K1, MAP3K20 ALDH1A1 2710/4885
US-20210107932-A1 NEOMYCIN AND PAROMOMYCIN DERIVATIVES NEK9, NEK5, NEK1 ALDH1A1 4659/4885

“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.