SCHEMBL6665448

SCHEMBL6665448

CCCCCN1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.52
ACE2 Q9BYF1 5/20 0.52
ALDH1A1 P00352 2/20 0.49
HSD17B10 Q99714 1/20 0.49
LMNA P02545 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
KCNH2 Q12809 1/20 0.48
ITGB1 P05556 2/20 0.48
ITGA5 P08648 2/20 0.48
NR1I2 O75469 1/20 0.47
F2 P00734 1/20 0.47
PLG P00747 1/20 0.47
POLB P06746 1/20 0.46
TACR1 P25103 2/20 0.46
FAAH O00519 2/20 0.45

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
SCHEMBL6665446 1.00 ACE (0.52) ACEACE2ALDH1A1HSD17B10LMNA
SCHEMBL26079422 0.83 LMNA (0.56) ACEACE2ALDH1A1HSD17B10LMNA
SCHEMBL6429637 0.82 FKBP1A (0.67) ACEACE2ALDH1A1HSD17B10ITGB1
SCHEMBL7066815 0.81 FKBP1A (0.61) ACEACE2ALDH1A1HSD17B10LMNA
SCHEMBL29413761 0.80 ALDH1A1 (0.61) ACEACE2ALDH1A1HSD17B10LMNA
SCHEMBL6369038 0.79 ITGB1 (0.54) ACEALDH1A1HSD17B10LMNATDP1
SCHEMBL7707493 0.79 ITGB1 (0.60) ALDH1A1HSD17B10LMNATDP1ITGB1
SCHEMBL30468238 0.79 SLC6A2 (0.56) F2PLG
SCHEMBL7066929 0.78 ITGB1 (0.61) ACEALDH1A1HSD17B10LMNATDP1
SCHEMBL27538863 0.78 ITGB1 (0.61) ACEALDH1A1HSD17B10LMNATDP1

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
JP-8325131-A None JP disclosed
JP-2004339241-A COSMETIC KYOWA HAKKO KOGYO CO LTD 2004-12-02 JP disclosed
JP-H08325131-A COSMETIC KYOWA HAKKO KOGYO CO LTD 1996-12-10 JP disclosed