SCHEMBL4646750

SCHEMBL4646750

CC(C)N(C)C(=O)N(C1CCCCC1)N1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 2/20 0.36
ADH1A P07327 2/20 0.36
ADH1B P00325 1/20 0.36
LIPE Q05469 1/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
FDPS P14324 1/20 0.33
CNR2 P34972 1/20 0.32
TSHR P16473 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL2606340 0.72 ALOX5 (0.41) ALDH1A1FDPSTSHRSMN1; SMN2
SCHEMBL2606357 0.72 ALOX5 (0.41) ALDH1A1FDPSTSHRSMN1; SMN2
SCHEMBL2281424 0.68 SLC6A4 (0.42) ADH1CADH1AADH1BFDPSTSHR
SCHEMBL17704769 0.67 ADH1C (0.41) ADH1CADH1AADH1BLIPEALDH1A1
SCHEMBL27915666 0.67 HTT (0.49) ALDH1A1MAPTSMN1; SMN2
SCHEMBL24518383 0.65 LIPE (0.44) LIPEALDH1A1CNR2TSHRKMT2A
SCHEMBL15551380 0.65 LIPE (0.44) LIPEALDH1A1CNR2TSHRKMT2A
SCHEMBL11535495 0.65 ADH1C (0.42) ADH1CADH1AADH1BLIPELMNA
SCHEMBL28019652 0.65 LIPE (0.44) LIPEALDH1A1CNR2TSHRKMT2A
SCHEMBL8598786 0.64 ADH1A (0.39) ADH1CADH1AADH1BLMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685102-A4 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD (KR) 2008-08-20 EP disclosed
EP-1685102-A1 MELANOCORTIN RECEPTOR AGONISTS LG Life Sciences Ltd. (KR) 2006-08-02 EP disclosed
WO-2005047251-A1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD. (KR) 2005-05-26 WO disclosed