SCHEMBL723652

SCHEMBL723652

CC(C)COCOCC(C)C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 2/20 0.31

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
SCHEMBL16267701 0.96 ALDH1A1 (0.36) ALDH1A1
SCHEMBL16267281 0.96 ALDH1A1 (0.36) ALDH1A1
SCHEMBL3376457 0.96 ALDH1A1 (0.36) ALDH1A1
SCHEMBL8893978 0.96 ALDH1A1 (0.36) ALDH1A1
SCHEMBL16267272 0.96 ALDH1A1 (0.36) ALDH1A1
SCHEMBL2096964 0.87
SCHEMBL4273964 0.85
SCHEMBL10583089 0.85
SCHEMBL8811539 0.85
SCHEMBL24856 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US claimed
JP-5086074-A None JP disclosed
US-11788026-B2 Hydraulic fluid AFTON CHEMICAL CORPORATION (US) 2023-10-17 US disclosed
EP-4213627-A1 STABILIZATION OF THIOKETONES ON SURFACES Bayer Aktiengesellschaft (DE) 2023-07-26 EP disclosed
US-20230181746-A1 BENZOYLHYDRAZIDE-DERIVED HDAC DEGRADERS AS THERAPEUTICS FOR TREATING CANCER AND OTHER HUMAN DISEASES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2023-06-15 US disclosed
EP-4124647-A1 HYDRAULIC FLUID Afton Chemical Corporation (US) 2023-02-01 EP disclosed
EP-4124646-A1 HYDRAULIC FLUID Afton Chemical Corporation (US) 2023-02-01 EP disclosed
US-11542224-B2 Synthesis of and compositions containing diaminoacetals and diaminoketals ADITYA BIRLA CHEMICALS (USA), INC. (US) 2023-01-03 US disclosed
US-20220183279-A1 STABILIZED THIOKETONE FORMULATIONS BAYER AKTIENGESELLSCHAFT (DE) 2022-06-16 US disclosed
CN-111093374-B STABILIZED PROSTABILIZER-CONTAINING FORMULATIONS WITH LOW 2- (1-CHLOROCYCLOPROPYL) -1- (2-CHLOROPHENYL) -3- (1H-1,2, 4-TRIAZOL-1-YL) PROPAN-2-OL CONTENT 拜耳股份公司 2022-06-10 CN disclosed
EP-0945445-A1 1,5-BENZODIAZEPINE DERIVATIVES ZERIA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed
JP-H0586074-A PREPARATION OF ALKOXY-OXIMINOSILANE ALLIED SIGNAL INC 1993-04-06 JP disclosed
EP-0290551-B1 COLD SETTING BINDING AGENT FOR MOULD MATERIALS AND APPLICATION THEREOF Hüttenes-Albertus Chemische-Werke GmbH (DE) 1992-08-05 EP disclosed
EP-0321815-A2 Process for the preparation of etherified methylol alkyl ureas, dispersions and use thereof Pfersee Chemie GmbH (DE) 1989-06-28 EP disclosed
EP-0268172-A1 Cold setting mold material binder and its use Hüttenes-Albertus Chemische-Werke GmbH (DE) 1988-05-25 EP disclosed
US-4172068-A POLYOL, POLYISOCYANATE; ACETAL OR KETAL AS SOLVENT INTERNATIONAL MINERALS & CHEMICAL CORPORATION (US) 1979-10-23 US disclosed
US-4116916-A BINDER, PHENOL-FORMALDEHYDE RESIN, POLYISOCYANATE, SOLVENT INTERNATIONAL MINERALS & CHEMICAL CORP. (US) 1978-09-26 US disclosed
US-4108838-A Process for the production of solid thermoplastic terpolymerizate of trioxane DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1978-08-22 US disclosed
US-4071568-A ACETAL WITH CARBON MONOXIDE MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JA) 1978-01-31 US disclosed
US-4051092-A CURABLE RESIN, POLYISOCYANATE INTERNATIONAL MINERALS & CHEMICAL CORPORATION (US) 1977-09-27 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 (4 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-11788026-B2 Hydraulic fluid OR10J3, OXSR1, NOX5 ALDH1A1 2187/4885TSHR 1466/4885
US-20220183279-A1 STABILIZED THIOKETONE FORMULATIONS TXK, KHK, PTMA ALDH1A1 2478/4885TSHR 3354/4885
US-20230181746-A1 BENZOYLHYDRAZIDE-DERIVED HDAC DEGRADERS AS THERAPEUTICS FOR TREATING CANCER AND OTHER HUMAN DISEASES HDAC3, HDAC1, HDAC5 ALDH1A1 1578/4885TSHR 1503/4885
US-11542224-B2 Synthesis of and compositions containing diaminoacetals and diaminoketals SRM, AOC1, SAT1 ALDH1A1 914/4885TSHR 4623/4885

“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.