SCHEMBL133108

SCHEMBL133108

CC(=O)OC(=O)C1CCCCC1C(=O)OC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
EPHX1 P07099 1/20 0.38
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 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
SCHEMBL10779925 0.91 KDM4E (0.41) ALDH1A1TSHRTP53CYP3A4HSD17B10
SCHEMBL237267 0.82 ALDH1A1 (0.36) ALDH1A1TSHRTP53CYP3A4EPHX1
SCHEMBL28942386 0.81 HSD17B10 (0.44) ALDH1A1TP53CYP3A4EPHX1HSD17B10
SCHEMBL776017 0.80 ALDH1A1 (0.43) ALDH1A1TSHRHSD17B10TDP1HTT
SCHEMBL1480017 0.79 ALDH1A1 (0.41) ALDH1A1TSHRTP53CYP3A4EPHX1
SCHEMBL12517329 0.78 CES2 (0.46) ALDH1A1TSHRTDP1HTTSMN1; SMN2
SCHEMBL776393 0.78 CES2 (0.46) ALDH1A1TSHRTDP1HTTSMN1; SMN2
SCHEMBL28071118 0.78 CHRM2 (0.44) TP53CYP3A4SLC6A2SLC6A4SMN1; SMN2
SCHEMBL28840080 0.77 TP53 (0.42) ALDH1A1TP53CYP3A4EPHX1SLC6A2
SCHEMBL17033364 0.76 CES2 (0.44) ALDH1A1TSHRTDP1HTTSMN1; SMN2

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 1798 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112741816-A Novel colon drug delivery system 江苏集萃新型药物制剂技术研究所有限公司 2021-05-04 CN claimed
US-20200254041-A1 RAPID ONSET AND EXTENDED ACTION PLANT-BASED AND SYNTHETIC CANNABINOID FORMULATIONS RECEPTOR HOLDINGS, INC. (US) 2020-08-13 US claimed
EP-3672610-A1 RAPID ONSET AND EXTENDED ACTION PLANT-BASED AND SYNTHETIC CANNABINOID FORMULATIONS Receptor Holdings, Inc. (US) 2020-07-01 EP claimed
CN-111225678-A Plant and synthetic cannabinoid formulations with rapid onset and prolonged action 受体控股公司 2020-06-02 CN claimed
EP-3607938-A2 PHARMACEUTICAL COMPOSITION Sovic Brkicic Ljiljana (HR) 2020-02-12 EP claimed
EP-2694038-B1 PHARMACEUTICAL COMPOSITION SOVIC BRKICIC LJILJANA (HR) 2019-05-29 EP claimed
US-20190142801-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2019-05-16 US claimed
US-20190125683-A1 Once Daily Formulations Of Tetracyclines SHIRE LABORATORIES, INC. 2019-05-02 US claimed
WO-2019071213-A1 RAPID ONSET AND EXTENDED ACTION PLANT-BASED AND SYNTHETIC CANNABINOID FORMULATIONS RECEPTOR LIFE SCIENCES, INC. (US) 2019-04-11 WO claimed
US-9744137-B2 Topiramate compositions and methods of enhancing its bioavailability SUPERNUS PHARMACEUTICALS, INC. (US) 2017-08-29 US claimed
EP-0409930-A1 PROCESS FOR FORMING ANTI-HALATION LAYERS ON POLYESTER PHOTOGRAPHIC FILM SUPPORTS. EASTMAN KODAK CO (US) 1991-01-30 EP claimed
WO-1990005939-A1 PROCESS FOR FORMING ANTI-HALATION LAYERS ON POLYESTER PHOTOGRAPHIC FILM SUPPORTS EASTMAN KODAK COMPANY (US) 1990-05-31 WO claimed
US-4914011-A POLYETHYLENE TEREPHTHALATE, CARBON BLACK AND CELLULOSE ACETATE HEXA HYDROPHTHALATE EASTMAN KODAK COMPANY (US) 1990-04-03 US claimed
US-4863744-A Intestine drug delivery ALZA CORPORATION (US) 1989-09-05 US claimed
US-4705515-A Dosage form for administering drug of the colon ALZA CORPORATION (US) 1987-11-10 US claimed
US-4503030-A Device for delivering drug to certain pH environments ALZA CORPORATION (US) 1985-03-05 US claimed
EP-0069259-B1 PROLONGED-ACTION FORM OF BROMOHEXINE, AND PROCESS FOR ITS PREPARATION Dr. Karl Thomae GmbH (DE) 1985-01-09 EP claimed
US-4438091-A FOR RESPIRATORY DISORDERS DR. KARL THOMAE GMBH (DE) 1984-03-20 US claimed
US-4367217-A Dipyricamole sustained release forms comprising lacquer-coated particles and the preparation thereof BOEHRINGER INGELHEIM GMBH (DE) 1983-01-04 US claimed
US-3957523-A CELLULOSE DERIVATIVES SHINETSU CHEMICAL COMPANY (JA) 1976-05-18 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20190142801-A1 USE OF SMALL MOLECULES FOR THE TREATMENT OF CLOSTRIDIUM DIFFICILE TOXICITY SLC10A2, TCERG1, SBDS ALDH1A1 1636/4885TSHR 1028/4885TP53 3506/4885
US-20200254041-A1 RAPID ONSET AND EXTENDED ACTION PLANT-BASED AND SYNTHETIC CANNABINOID FORMULATIONS FAAH, CNR1, GPR18 ALDH1A1 4335/4885TSHR 2545/4885TP53 4875/4885

“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.