Decane

Decane

SCHEMBL5361009

CCCC=O.CCCCCCCCCC

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.78
ALDH1A1 P00352 2/20 0.75
FAAH O00519 2/20 0.67
TRPV1 Q8NER1 2/20 0.67
ADH1B P00325 3/20 0.55
ADH1A P07327 3/20 0.55
ADH7 P40394 3/20 0.55
ADH1C P00326 2/20 0.55
EPHX1 P07099 1/20 0.55
ADH4 P08319 1/20 0.55
THRB P10828 1/20 0.50
DNM1 Q05193 3/20 0.45
HIF1A Q16665 1/20 0.44

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
Heptane SCHEMBL6926414 1.00 TSHR (0.78) TSHRALDH1A1FAAHTRPV1ADH1B
Hexane SCHEMBL6930185 0.97 ALDH1A1 (0.80) TSHRALDH1A1FAAHTRPV1ADH1B
Heptanal SCHEMBL11225715 0.94 TSHR (0.89) TSHRALDH1A1FAAHTRPV1ADH1B
Hexanal SCHEMBL825305 0.91 TSHR (0.83) TSHRALDH1A1FAAHTRPV1ADH1B
Undecanal SCHEMBL2684955 0.88 TSHR (1.00) TSHRALDH1A1FAAHTRPV1ADH1B
Tridecanal SCHEMBL38928 0.88 TSHR (1.00) TSHRALDH1A1FAAHTRPV1ADH1B
Decanal SCHEMBL7728978 0.88 TSHR (1.00) TSHRALDH1A1FAAHTRPV1ADH1B
Heptanal SCHEMBL10533943 0.88 TSHR (1.00) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL120789 0.88 TSHR (1.00) TSHRALDH1A1FAAHTRPV1ADH1B
SCHEMBL9234870 0.88 TSHR (1.00) TSHRALDH1A1FAAHTRPV1ADH1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202019-B2 Photothermographic imaging material KONICA MINOLTA HOLDINGS, INC. (JP) 2007-04-10 US disclosed
US-7153645-B2 Silver salt photo-thermal photographic dry imaging material, an image recording method and an image forming method KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2006-12-26 US disclosed
US-20050032010-A1 Silver salt photo-thermal photographic dry imaging material, an image recording method and an image forming method KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2005-02-10 US disclosed
EP-1505436-A1 A silver salt photothermographic dry imaging material Konica Minolta Medical & Graphic, Inc. (JP) 2005-02-09 EP disclosed
US-20040101794-A1 Photothermographic imaging material KONICA MINOLTA HOLDINGS, INC. (JP) 2004-05-27 US disclosed