Decane

Decane

SCHEMBL4288829

CCCCCCCCCC.[N-]=[N+]=N

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
THRB P10828 1/20 0.57
CA1 P00915 1/20 0.43
CA6 P23280 1/20 0.43
CA5A P35218 1/20 0.43
CA9 Q16790 1/20 0.43
CA5B Q9Y2D0 1/20 0.43
DNM1 Q05193 6/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 1/20 0.42
SLC22A1 O15245 1/20 0.42

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
Decane SCHEMBL4288830 0.97 TSHR (0.53) TSHRTHRBCA1CA6CA5A
Pentane SCHEMBL88249 0.86 TSHR (0.50) TSHRTHRBCA1CA6CA5A
Octane SCHEMBL28818930 0.85 TSHR (0.67) TSHRTHRBDNM1ALDH1A1LMNA
Pentadecane SCHEMBL28249592 0.85 TSHR (0.67) TSHRTHRBDNM1ALDH1A1LMNA
Octane SCHEMBL23933879 0.85 TSHR (0.67) TSHRTHRBDNM1ALDH1A1LMNA
Decane SCHEMBL23933878 0.85 TSHR (0.67) TSHRTHRBDNM1ALDH1A1LMNA
Hexadecane SCHEMBL28526152 0.85 TSHR (0.67) TSHRTHRBDNM1ALDH1A1LMNA
Dodecane SCHEMBL28062385 0.85 TSHR (0.67) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL8541557 0.84 TSHR (0.40) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL14746519 0.82

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
EP-2138527-A1 Nanoparticle, method for producing a nanoparticle, nanoparticle system and its use Freie Universität Berlin (DE) 2009-12-30 EP disclosed
WO-2009156455-A1 METHOD FOR PRODUCING A NANOPARTICLE, NANOPARTICLE, NANOPARTICLE SYSTEM AND ITS USE FREIE UNIVERSITÄT BERLIN (DE) 2009-12-30 WO disclosed
EP-1565443-A4 ACETYL 2-HYDROXY-1,3 DIAMINOALKANES ELAN PHARM INC (US) 2007-07-18 EP disclosed
EP-1751091-A2 2-AMINO- AND 2-THIO-SUBSTITUTED 1,3-DIAMINOPROPANES Elan Pharmaceuticals, Inc. (US) 2007-02-14 EP disclosed
WO-2005095326-A2 2-AMINO- AND 2-THIO-SUBSTITUTED 1,3-DIAMINOPROPANES ELAN PHARMACEUTICALS, INC. (US) 2005-10-13 WO disclosed
EP-1565443-A2 ACETYL 2-HYDROXY-1,3 DIAMINOALKANES Elan Pharmaceuticals, Inc. (US) 2005-08-24 EP disclosed
WO-2004024081-A2 ACETYL 2-HYDROXY-1,3 DIAMINOALKANES ELAN PHARMACEUTICALS, INC. (US) 2004-03-25 WO disclosed