SCHEMBL329469

SCHEMBL329469

O=CC1CCCCCCCCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 13/20 0.41
ADH1C P00326 10/20 0.41
ADH1B P00325 5/20 0.41
ADH4 P08319 3/20 0.41
ADH7 P40394 3/20 0.36
CES2 O00748 1/20 0.33
CES1 P23141 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
SCHEMBL11734533 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
Cyclononanecarbaldehyde SCHEMBL1920808 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
SCHEMBL11341547 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
Cyclopentanecarbaldehyde SCHEMBL14575123 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
SCHEMBL493755 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
SCHEMBL3036861 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
Cycloheptane Carbaldehyde SCHEMBL95620 1.00
SCHEMBL59918 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
Cycloundecane Carbaldehyde SCHEMBL1901240 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7
SCHEMBL3027683 1.00 ADH1A (0.41) ADH1AADH1CADH1BADH4ADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115160127-B Method for preparing long carbon chain dibasic acid through co-oxidation reaction 中国天辰工程有限公司 2024-06-11 CN claimed
US-20140162937-A1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS LTD. (FI) 2014-06-12 US claimed
US-8680234-B2 Polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS OY (FI) 2014-03-25 US claimed
US-8329645-B2 Polymyxin derivatives and uses thereof NORTHERN ANTIBIOTICS LTD. (FI) 2012-12-11 US claimed
US-8138248-B2 Method to improve cold flow resistance of polymers BRIDGESTONE CORPORATION (JP) 2012-03-20 US claimed
US-20100292136-A1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS OY (FI) 2010-11-18 US claimed
US-20100004361-A1 METHOD TO IMPROVE COLD FLOW RESISTANCE OF POLYMERS BRIDGESTONE CORPORATION (JP) 2010-01-07 US claimed
US-20090215677-A1 POLYMYXIN DERIVATIVES AND USES THEREOF NORTHERN ANTIBIOTICS LTD. (FI) 2009-08-27 US claimed
US-4181810-A FROM THE 2-SUBSTITUTED ETHANAL AND FORMALDEHYDE USING AN ACID ION EXCHANGER; HYDROGENATION OF REACTION PRODUCT BAYER AKTIENGESELLSCHAFT (DE) 1980-01-01 US claimed
US-4020059-A Process for preparing tertiary amines NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JA) 1977-04-26 US claimed
US-20250123289-A1 Derivatization Reagent, Derivatization Reagent Kit, and Method for Improving Sensitivity of Nitrogen-Containing Compound in Mass Spectrometry JEOL LTD. (JP) 2025-04-17 US disclosed
EP-4538710-A1 DERIVATIZATION REAGENT, DERIVATIZATION REAGENT KIT, AND METHOD FOR IMPROVING SENSITIVITY OF NITROGEN-CONTAINING COMPOUND IN MASS SPECTROMETRY JEOL Ltd. (JP) 2025-04-16 EP disclosed
CN-119804875-A Derivatization reagent, derivatization kit, and method for improving sensitivity of nitrogen-containing compound in mass spectrometry 日本电子株式会社 2025-04-11 CN disclosed
CN-116020552-B Butadiene cyclization trimerization catalyst, preparation method and application thereof 中国石油化工股份有限公司 2024-10-11 CN disclosed
CN-115160127-B Method for preparing long carbon chain dibasic acid through co-oxidation reaction 中国天辰工程有限公司 2024-06-11 CN disclosed
US-4181810-A FROM THE 2-SUBSTITUTED ETHANAL AND FORMALDEHYDE USING AN ACID ION EXCHANGER; HYDROGENATION OF REACTION PRODUCT BAYER AKTIENGESELLSCHAFT (DE) 1980-01-01 US disclosed
US-4153606-A Process for the production of thiazoline-(3) compounds DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1979-05-08 US disclosed
US-4081459-A Trioxa-1, 5, 7 spiro [2,5] octanes and their method of preparation PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1978-03-28 US disclosed
US-4020059-A Process for preparing tertiary amines NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JA) 1977-04-26 US disclosed
US-3931208-A Process for the production of thiazolines-(3) DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1976-01-06 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-20090215677-A1 POLYMYXIN DERIVATIVES AND USES THEREOF C5, C9, C3AR1 ADH1A 4879/4885ADH1C 4883/4885ADH1B 4781/4885
US-20140162937-A1 POLYMYXIN DERIVATIVES AND USES THEREOF SLC11A2, TLR2, TLR5 ADH1A 4872/4885ADH1C 4883/4885ADH1B 4804/4885
US-20100292136-A1 POLYMYXIN DERIVATIVES AND USES THEREOF C5, C9, C3AR1 ADH1A 4879/4885ADH1C 4883/4885ADH1B 4781/4885

“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.