SCHEMBL3551705

SCHEMBL3551705

CCN(CCCO)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 2/20 0.50
TDP1 Q9NUW8 1/20 0.40
SSTR4 P31391 1/20 0.37
HDAC6 Q9UBN7 2/20 0.37
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
CA12 O43570 3/20 0.36
CA1 P00915 3/20 0.36
CA9 Q16790 2/20 0.36
CA7 P43166 1/20 0.33
NAMPT P43490 1/20 0.33
MLYCD O95822 1/20 0.33
LMNA P02545 1/20 0.33
CTSK P43235 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC3 O15379 1/20 0.32
NCOR2 Q9Y618 1/20 0.32

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
SCHEMBL4574540 0.95 CA14 (0.53) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL19772708 0.93 CA14 (0.51) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL14157489 0.90 CA14 (0.58) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL6130651 0.90 CA14 (0.52) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL15085740 0.89 CA14 (0.53) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL896291 0.89 CA14 (0.45) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL19929679 0.87 CA14 (0.53) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL14175259 0.87 CA12 (0.50) CA14HDAC6HDAC1HDAC2CA12
SCHEMBL27252832 0.87 CA14 (0.55) CA14TDP1SSTR4HDAC6HDAC1
SCHEMBL25797677 0.87 CA14 (0.59) CA14TDP1SSTR4HDAC6HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023178099-A1 NLRP3 MODULATORS ZOMAGEN BIOSCIENCES LTD (US) 2023-09-21 WO disclosed
US-11623922-B2 Compounds INFLAZOME LIMITED (IE) 2023-04-11 US disclosed
US-20200331886-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2020-10-22 US disclosed
US-20200331886-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2020-10-22 US disclosed
EP-3692020-A1 NOVEL COMPOUNDS Inflazome Limited (IE) 2020-08-12 EP disclosed
WO-2019068772-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2019-04-11 WO disclosed
WO-2019068772-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2019-04-11 WO disclosed
US-8084643-B2 Nitrogen-containing esters of the secondary alcohol group of florfenicol and of its analogs,including salts; veterinary medicine; nonhydrolyzing as needed to maintain the prodrug in aqueous solution in the subjects system until appropriate; cattle drinking water; bovine respiratory disease INTERVET INC. (US) 2011-12-27 US disclosed
US-7727998-B2 Melanin-concentrating hormone receptor antagonists containing piperidine derivatives as the active ingredient BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
US-20080188556-A1 Water-Soluble Prodrugs of Florfenicol and its Analogs SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2008-08-07 US disclosed
US-20060106046-A1 Melanin-concentrating hormone receptor antagonists containing piperidine derivatives as the active ingredient MSD K.K. (JP) 2006-05-18 US disclosed
EP-1595867-A1 MELANIN-CONCENTRATING HORMONE RECEPTOR ANTAGONISTS CONTAINING PIPERIDINE DERIVATIVES AS THE ACTIVE INGREDIENT BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-11-16 EP disclosed
EP-0815081-B1 PIPERIDINYL-2-ALKYL SUBSTITUTED LINEAR POLYAMINES FOR THE REDUCTION OF INTRACELLULAR, ENDOGENIC POLYAMINE LEVELS SUCH AS PUTRESCINE, SPERMIDINE AND SPERMINE, AND THEIR IMPACT ON CELL PROLIFERATION NOVARTIS AG (CH) 2001-10-04 EP disclosed
US-5834486-A ANTIPROLIFERATIVE, ANTIPROTOZOA AGENTS NOVARTIS AG (CH) 1998-11-10 US disclosed
EP-0815081-A1 PIPERIDINYL-2-ALKYL SUBST. LINEAR POLYAMINES FOR THE REDUCTION OF INTRACELLULAR, ENDOGENIC POLYAMINE LEVELS SUCH AS PUTRESCINE, SPERMIDINE AND SPERMINE, AND THEIR IMPACT ON CELL PROLIFERATION Novartis AG (CH) 1998-01-07 EP disclosed
WO-1996028425-A1 PIPERIDINYL-2-ALKYL SUBST. LINEAR POLYAMINES FOR THE REDUCTION OF INTRACELLULAR, ENDOGENIC POLYAMINE LEVELS SUCH AS PUTRESCINE, SPERMIDINE AND SPERMINE, AND THEIR IMPACT ON CELL PROLIFERATION NOVARTIS AG (CH) 1996-09-19 WO 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-11623922-B2 Compounds NLRP3, NOD1, NLRP1 CA14 4070/4885TDP1 1642/4885SSTR4 2960/4885
US-20200331886-A1 NOVEL COMPOUNDS NLRP3, NOD1, NLRP1 CA14 4548/4885TDP1 1391/4885SSTR4 3437/4885
US-20080188556-A1 Water-Soluble Prodrugs of Florfenicol and its Analogs PFAS, ADH5, SI CA14 1565/4885TDP1 860/4885SSTR4 3399/4885
US-20060106046-A1 Melanin-concentrating hormone receptor antagonists containing piperidine derivatives as the active ingredient MCHR1, MC1R, PRLHR CA14 4764/4885TDP1 4687/4885SSTR4 24/4885

“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.