SCHEMBL4378592

SCHEMBL4378592

CC(C)C(=O)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.59
DBH P09172 1/20 0.59
GAA P10253 1/20 0.59
RECQL P46063 1/20 0.59
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
CA12 O43570 4/20 0.54
CA7 P43166 4/20 0.54
CA9 Q16790 4/20 0.54
CA14 Q9ULX7 4/20 0.54
PDPK1 O15530 1/20 0.54
ESR1 P03372 3/20 0.52
ESR2 Q92731 3/20 0.52
LMNA P02545 2/20 0.52
MAPT P10636 1/20 0.52
PKM P14618 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
CA3 P07451 1/20 0.50
TYR P14679 1/20 0.50

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
SCHEMBL10121174 0.89 KDM4E (0.62) KDM4EDBHGAARECQLCA1
SCHEMBL13687470 0.88 PARP10 (0.58) KDM4EDBHGAARECQLCA1
SCHEMBL24473673 0.86 KDM4E (0.47) KDM4EDBHGAARECQLCA1
Phenol SCHEMBL14718671 0.84 CES2 (0.50) KDM4EDBHGAARECQLCA1
SCHEMBL481087 0.83 CA1 (0.52) KDM4EDBHGAARECQLCA1
SCHEMBL10941943 0.82 KDM4E (0.56) KDM4EDBHGAARECQLESR1
SCHEMBL12418688 0.82 KDM4E (0.56) KDM4EDBHGAARECQLPDPK1
Hydroxylated Completely Delakylated Diethylpropion SCHEMBL27460979 0.81 CA1 (0.50) CA1CA2CA12CA7CA9
SCHEMBL2818719 0.81 CA1 (0.50) CA1CA2CA12CA7CA9
SCHEMBL27467685 0.81 CA1 (0.50) KDM4EDBHGAARECQLCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013173332-A1 METHOD FOR SELECTIVE PRODUCTION OF BIOBASED CHEMICALS AND BIOFUELS FROM PLANT LIGNIN Vertichem Corporation (CA) 2013-11-21 WO claimed
US-20130232853-A1 METHOD FOR SELECTIVE PRODUCTION OF BIOBASED CHEMICALS AND BIOFUELS FROM PLANT LIGNIN THESIS CHEMISTRY, LLC (US) 2013-09-12 US claimed
US-20130232852-A1 METHOD FOR TIERED PRODUCTION OF BIOBASED CHEMICALS AND BIOFUELS FROM LIGNIN THESIS CHEMISTRY, LLC (US) 2013-09-12 US claimed
WO-2013134756-A1 A METHOD FOR TIERED PRODUCTION OF BIOBASED CHEMICALS AND BIOFUELS FROM LIGNIN Vertichem Corporation (CA) 2013-09-12 WO claimed
EP-0019151-B1 USE OF PHENOL-ISOBUTYRALDEHYDE-POLYCONDENSATION PRODUCTS AS LAKING AGENTS FOR BASIC COLORANTS BASF Aktiengesellschaft (DE) 1982-02-03 EP claimed
EP-4237008-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF Elucida Oncology, Inc. (US) 2023-09-06 EP disclosed
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 US disclosed
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 US disclosed
WO-2023028350-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) 2023-03-02 WO disclosed
CN-111056890-B Method for preparing aryl ketone by free radical-free radical coupling reaction of ketoacid decarboxylation and fatty aldehyde decarbonylation based on iron catalysis 湘潭大学 2022-10-14 CN disclosed
WO-2022093800-A2 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. (US) 2022-05-05 WO disclosed
US-20210393557-A1 Regulators of the Endoplasmic Reticulum Proteostasis Network THE SCRIPPS RESEARCH INSTITUTE 2021-12-23 US disclosed
WO-1994022835-A2 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1994-10-13 WO disclosed
WO-1994022834-A1 HETEROCYCLIC DERIVATIVES AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1994-10-13 WO disclosed
US-5179229-A Preparation of 2,2-diorgano-3-arylpropionic acids and esters thereof HOECHST CELANESE CORPORATION (US) 1993-01-12 US disclosed
US-5026729-A Lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1991-06-25 US disclosed
US-5012007-A Method for producing 1-indanone derivatives HOECHST CELANESE CORPORATION, A CORP. OF DE 1991-04-30 US disclosed
EP-0421759-A2 Method for producing 1-indanone derivatives HOECHST CELANESE CORPORATION (US) 1991-04-10 EP disclosed
EP-0365340-A2 Copolymers of 4-hydroxystyrene and alkyl substituted-4-hydroxystyrene HOECHST CELANESE CORPORATION (US) 1990-04-25 EP disclosed
EP-0019151-A1 Use of phenol-isobutyraldehyde-polycondensation products as laking agents for basic colorants BASF Aktiengesellschaft (DE) 1980-11-26 EP 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-20210393557-A1 Regulators of the Endoplasmic Reticulum Proteostasis Network XBP1, HSPA5, TFEB KDM4E 3936/4885DBH 2005/4885GAA 44/4885
US-20130232852-A1 METHOD FOR TIERED PRODUCTION OF BIOBASED CHEMICALS AND BIOFUELS FROM LIGNIN DCXR, AGL, GLO1 KDM4E 738/4885DBH 80/4885GAA 324/4885
US-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF NDC1, KIFC1, SDCBP KDM4E 4310/4885DBH 1438/4885GAA 307/4885
US-20130232853-A1 METHOD FOR SELECTIVE PRODUCTION OF BIOBASED CHEMICALS AND BIOFUELS FROM PLANT LIGNIN HAAO, HAO2, HACL2 KDM4E 1827/4885DBH 16/4885GAA 177/4885

“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.