Nonane

Nonane

SCHEMBL3968062

CC(=O)O.CCCCCCCCC

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Nonane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 known ✓ P03372 1/20 0.63
GPR84 Q9NQS5 7/20 0.63
PPARG P37231 7/20 0.63
PPARD Q03181 7/20 0.63
PPARA Q07869 7/20 0.63
HDAC11 Q96DB2 5/20 0.63
TSHR P16473 5/20 0.63
PTPN1 P18031 3/20 0.63
ALDH1A1 P00352 2/20 0.63
TLR2 O60603 2/20 0.63
TDP1 Q9NUW8 2/20 0.63
FABP4 P15090 2/20 0.63
KMT2A Q03164 2/20 0.63
SLC22A6 Q4U2R8 1/20 0.63
SLC22A8 Q8TCC7 1/20 0.63
MEN1 O00255 1/20 0.63
ALOX15 P16050 1/20 0.63
PDE4A P27815 1/20 0.63
PDE3A Q14432 1/20 0.63
HSD17B10 Q99714 1/20 0.63

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
Dodecane SCHEMBL28390898 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Octane SCHEMBL6663108 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Heptane SCHEMBL16058605 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Hexadecane SCHEMBL14718769 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Dodecane SCHEMBL14718935 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Nonane SCHEMBL23929397 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Decane SCHEMBL14718768 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Undecane SCHEMBL14719515 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Heptane SCHEMBL1049410 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11
Heptane SCHEMBL28166995 1.00 GPR84 (0.63) GPR84PPARGPPARDPPARAHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112034681-B Composition for forming organic film, pattern forming method, and polymer 信越化学工业株式会社 2024-08-20 CN disclosed
CN-101448785-B Novel dipeptidyl peptidase iv inhibitors and processes for preparation and pharmaceutical compositions thereof containing the same MATRIX LAB LTD 2013-03-27 CN disclosed
EP-1569694-B1 POLYAMINE CONJUGATES WITH ACIDIC RETINOIDS AND PREPARATION THEREOF PAPAIOANNOU DIONYSIOS (GR) 2009-11-25 EP disclosed
CN-101448785-A Novel dipeptidyl peptidase IV inhibitors and processes for their preparation and pharmaceutical compositions containing them MATRIX LAB LTD (IN) 2009-06-03 CN disclosed
US-7517913-B2 Polyamine conjugates with acidic retinoids and preparation thereof PAPAIOANNOU DIONYSIOS 2009-04-14 US disclosed
CN-101346387-A Pyrimido- [4, 5-]-oxazines for use as DGAT inhibitors ASTRAZENECA AB (SE) 2009-01-14 CN disclosed
US-7402602-B2 Imidazole derivatives modulating the sodium channels SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S) (FR) 2008-07-22 US disclosed
US-20070099975-A1 Imidazole derivatives modulating the sodium channels SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) 2007-05-03 US disclosed
US-7157483-B2 Imidazole derivatives modulating the sodium channels SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2007-01-02 US disclosed
US-20060189696-A1 Polyamine conjugates with acidic retinoids and preparation thereof PAPAIOANNOU DIONYSIOS 2006-08-24 US disclosed
US-20060069146-A1 Imidazole derivatives modulating the sodium channels SCRAS 2006-03-30 US disclosed
EP-1569694-A1 POLYAMINE CONJUGATES WITH ACIDIC RETINOIDS AND PREPARATION THEREOF Papaioannou, Dionysios (GR) 2005-09-07 EP disclosed
US-20050027143-A1 Process for the preparation of beta-ionylideneacetaldehyde RANBAXY LABORATORIES LIMITED (IN) 2005-02-03 US disclosed
US-20040198792-A1 Imidazole derivatives modulating the sodium channels IPSEN PHARMA S.A.S. (FR) 2004-10-07 US disclosed
EP-1421054-A2 PROCESS FOR THE PREPARATION OF BETA-IONYLIDENEACETALDEHYDE RANBAXY LABORATORIES, LTD. (IN) 2004-05-26 EP disclosed
WO-2004018001-A1 POLYAMINE CONJUGATES WITH ACIDIC RETINOIDS AND PREPARATION THEREOF PAPAIOANNOU DIONYSIOS (GR) 2004-03-04 WO disclosed
WO-2003018522-A2 PROCESS FOR THE PREPARATION OF BETA-IONYLIDENEACETALDEHYDE RANBAXY LABORATORIES LIMITED (IN) 2003-03-06 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 (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-20060189696-A1 Polyamine conjugates with acidic retinoids and preparation thereof RNASEL, RNASEH1, SNRPE ESR1 4166/4885GPR84 2314/4885PPARG 1017/4885
US-20040198792-A1 Imidazole derivatives modulating the sodium channels SCN1A, SCN1B, TRPV1 ESR1 3711/4885GPR84 1535/4885PPARG 2066/4885
US-20070099975-A1 Imidazole derivatives modulating the sodium channels SCN2B, KCNJ2, SCN1B ESR1 3764/4885GPR84 1788/4885PPARG 2151/4885
US-20050027143-A1 Process for the preparation of beta-ionylideneacetaldehyde ALDH1A2, ADH1B, ADH4 ESR1 4362/4885GPR84 1976/4885PPARG 1363/4885
US-20060069146-A1 Imidazole derivatives modulating the sodium channels SCN1B, SCN1A, SCN2B ESR1 4140/4885GPR84 2060/4885PPARG 2336/4885

“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.