SCHEMBL13246772

SCHEMBL13246772

CCCCCCCCCCCCCCC(=O)C(C)(C)C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.64
CES1 P23141 8/20 0.64
CES2 O00748 5/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
HSD17B10 Q99714 2/20 0.64
CYP1A2 P05177 1/20 0.64
PPARG P37231 5/20 0.54
PPARD Q03181 5/20 0.54
PPARA Q07869 5/20 0.54
HDAC11 Q96DB2 4/20 0.54
TSHR P16473 3/20 0.54
GPR84 Q9NQS5 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TLR2 O60603 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
FABP4 P15090 2/20 0.54
PTPN1 P18031 2/20 0.54
SLC22A6 Q4U2R8 1/20 0.54
SLC22A8 Q8TCC7 1/20 0.54

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
SCHEMBL14519725 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL3411867 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL8898693 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL9437438 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL8824699 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL23052919 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL16186191 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL16186192 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL22525240 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A
SCHEMBL16186190 1.00 FAAH (0.64) FAAHCES1CES2MEN1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066113-A1 MESSENGER RNA VACCINES AGAINST WIDE SPECTRUM OF CORONAVIRUS VARIANTS ACADEMIA SINICA (TW) 2024-02-29 US disclosed
US-20210177981-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED INSULIN DELIVERY MERCK SHARP & DOHME CORP. (US) 2021-06-17 US disclosed
WO-2021068464-A1 HEAT-NOT-BURN VAPOR GENERATING BODY AND PREPARATION METHOD THEREFOR, TOBACCO PRODUCT AND VAPOR GENERATING BODY 科巴特(深圳)生活科技有限公司 2021-04-15 WO disclosed
US-20150337013-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS MERCK SHARP & DOHME CORP. (US) 2015-11-26 US disclosed
US-20140073558-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CUBIST PHARMACEUTICALS, INC. (US) 2014-03-13 US disclosed
US-8507647-B2 Antibacterial agents for the treatment of gram positive infections CUBIST PHARMACEUTICALS, INC. (US) 2013-08-13 US disclosed
US-20100184649-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CUBIST PHARMACEUTICALS, INC. 2010-07-22 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 (5 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-20210177981-A1 CONJUGATE BASED SYSTEMS FOR CONTROLLED INSULIN DELIVERY GPR119, INSR, IGF1R FAAH 541/4885CES1 92/4885CES2 111/4885
US-20150337013-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 FAAH 1153/4885CES1 2802/4885CES2 3242/4885
US-20100184649-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 FAAH 1153/4885CES1 2802/4885CES2 3242/4885
US-20240066113-A1 MESSENGER RNA VACCINES AGAINST WIDE SPECTRUM OF CORONAVIRUS VARIANTS SARNP, RNGTT, RBM3 FAAH 2023/4885CES1 572/4885CES2 3437/4885
US-20140073558-A1 NOVEL ANTIBACTERIAL AGENTS FOR THE TREATMENT OF GRAM POSITIVE INFECTIONS CLPP, CLPTM1, RPN1 FAAH 1153/4885CES1 2802/4885CES2 3242/4885

“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.