SCHEMBL592985

SCHEMBL592985

C=C(C)C1CC(COC(C)=O)C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
PDK1 Q15118 1/20 0.31
NLRP3 Q96P20 1/20 0.30
HSD17B10 Q99714 2/20 0.30
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL1301519 1.00 ALDH1A1 (0.32) ALDH1A1PDK1NLRP3HSD17B10TDP1
SCHEMBL27756028 0.86 CD81 (0.33) ALDH1A1PDK1NLRP3HSD17B10LMNA
SCHEMBL22607997 0.84
SCHEMBL31474374 0.83 ALDH1A1 (0.37) ALDH1A1
SCHEMBL31508903 0.82
SCHEMBL22906487 0.82
SCHEMBL22608021 0.82 PTPN1 (0.36)
Acetic Acid SCHEMBL22607985 0.75
Acetic Acid SCHEMBL592986 0.75
SCHEMBL28507386 0.75 ATM (0.33) HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750129-A SOLID RESERVOIRS ENCAPSULATED WITH POROUS MEMBRANE PHERO TECH INC. (CA) 1998-05-12 US claimed
EP-3766862-B1 DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME SHINETSU CHEMICAL CO (JP) 2023-06-07 EP disclosed
US-20220324783-A1 DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-10-13 US disclosed
US-20220259136-A1 DIESTER COMPOUND HAVING A DIMETHYLCYCLOBUTANE RING, A PROCESS FOR PREPARING THE SAME, AND A PROCESS FOR PREPARING DIMETHYLCYCLOBUTANE COMPOUND DERIVED FROM THE DIESTER COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-08-18 US disclosed
US-11384043-B2 Dimethylcyclobutanone compounds, dimethylcyclobutane compounds, and processes for preparing the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-07-12 US disclosed
US-11352312-B2 Diester compound having a dimethylcyclobutane ring, a process for preparing the same, and a process for preparing dimethylcyclobutane compound derived from the diester compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-06-07 US disclosed
US-20210017115-A1 DIESTER COMPOUND HAVING A DIMETHYLCYCLOBUTANE RING, A PROCESS FOR PREPARING THE SAME, AND A PROCESS FOR PREPARING DIMETHYLCYCLOBUTANE COMPOUND DERIVED FROM THE DIESTER COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-01-21 US disclosed
US-20210017112-A1 DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-01-21 US disclosed
EP-1606334-B1 POLYAMIDE-POLYETHER BLOCK COPOLYMER CRODA INT PLC (GB) 2019-04-03 EP disclosed
EP-2099605-B1 COMPOSITION AND ARTICLES CONTAINING CROSS-LIINKED POLYMER MATRIX AND IMMOBILIZED ACTIVE LIQUID, AND METHODS OF MAKING SAME CRODA INT PLC (GB) 2018-04-18 EP disclosed
US-20090076175-A1 Polyamide-Polyether Block Copolymer ARIZONA CHEMICAL COMPANY LLC 2009-03-19 US disclosed
WO-2008079892-A1 COMPOSITION AND ARTICLES CONTAINING CROSS-LIINKED POLYMER MATRIX AND IMMOBILIZED ACTIVE LIQUID, AND METHODS OF MAKING SAME ARIZONA CHEMICAL COMPANY (US) 2008-07-03 WO disclosed
US-20080070025-A1 COMPOSITIONS AND ARTICLES CONTAINING A CROSS-LINKED POLYMER MATRIX AND AN IMMOBILIZED ACTIVE LIQUID, AS WELL AS METHODS OF MAKING AND USING THE SAME ARIZONA CHEMICAL COMPANY LLC 2008-03-20 US disclosed
US-20070244294-A1 POLYAMIDE-POLYETHER BLOCK COPOLYMER ARIZONA CHEMICAL COMPANY LLC 2007-10-18 US disclosed
US-20060052576-A1 Polyamide-polyether block copolymer ARIZONA CHEMICAL COMPANY (US) 2006-03-09 US disclosed
EP-1606334-A1 POLYAMIDE-POLYETHER BLOCK COPOLYMER Arizona Chemical Company (US) 2005-12-21 EP disclosed
US-6956099-B2 Polyamide-polyether block copolymer ARIZONA CHEMICAL COMPANY (US) 2005-10-18 US disclosed
WO-2004083280-A1 POLYAMIDE-POLYETHER BLOCK COPOLYMER ARIZONA CHEMICAL COMPANY (US) 2004-09-30 WO disclosed
US-20040186263-A1 having softening point of 60-180 degrees C, formed from reaction mixture comprising 1,4-cyclohexanedicarboxylic acid and compounds comprising polyalkyleneoxydiamine, reaction mixture containing no monofunctional compound reactive with amine or acid ARIZONA CHEMICAL COMPANY 2004-09-23 US disclosed
US-5750129-A SOLID RESERVOIRS ENCAPSULATED WITH POROUS MEMBRANE PHERO TECH INC. (CA) 1998-05-12 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 (8 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-20210017112-A1 DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME GGPS1, PFKFB4, PHOSPHO1 ALDH1A1 3369/4885PDK1 56/4885NLRP3 4799/4885
US-11384043-B2 Dimethylcyclobutanone compounds, dimethylcyclobutane compounds, and processes for preparing the same GGPS1, PFKFB4, PHOSPHO1 ALDH1A1 3369/4885PDK1 56/4885NLRP3 4799/4885
US-20210017115-A1 DIESTER COMPOUND HAVING A DIMETHYLCYCLOBUTANE RING, A PROCESS FOR PREPARING THE SAME, AND A PROCESS FOR PREPARING DIMETHYLCYCLOBUTANE COMPOUND DERIVED FROM THE DIESTER COMPOUND DHCR24, PHOSPHO1, CCNT1 ALDH1A1 4253/4885PDK1 167/4885NLRP3 4390/4885
US-20090076175-A1 Polyamide-Polyether Block Copolymer ACMSD, PARG, PGD ALDH1A1 2579/4885PDK1 844/4885NLRP3 297/4885
US-20220324783-A1 DIMETHYLCYCLOBUTANONE COMPOUNDS, DIMETHYLCYCLOBUTANE COMPOUNDS, AND PROCESSES FOR PREPARING THE SAME GGPS1, PFKFB4, PHOSPHO1 ALDH1A1 3369/4885PDK1 56/4885NLRP3 4799/4885
US-11352312-B2 Diester compound having a dimethylcyclobutane ring, a process for preparing the same, and a process for preparing dimethylcyclobutane compound derived from the diester compound DHCR24, PHOSPHO1, CCNT1 ALDH1A1 4253/4885PDK1 167/4885NLRP3 4390/4885
US-20070244294-A1 POLYAMIDE-POLYETHER BLOCK COPOLYMER ACMSD, PARG, PGD ALDH1A1 2579/4885PDK1 844/4885NLRP3 297/4885
US-20220259136-A1 DIESTER COMPOUND HAVING A DIMETHYLCYCLOBUTANE RING, A PROCESS FOR PREPARING THE SAME, AND A PROCESS FOR PREPARING DIMETHYLCYCLOBUTANE COMPOUND DERIVED FROM THE DIESTER COMPOUND DHCR24, PHOSPHO1, CCNT1 ALDH1A1 4253/4885PDK1 167/4885NLRP3 4390/4885

“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.