SCHEMBL8599070

SCHEMBL8599070

CC(C)CC(=O)NCC1CCC(C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
PLG P00747 1/20 0.43
PLAT P00750 1/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 4/20 0.40
CYP2C9 P11712 2/20 0.40
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
HPGD P15428 1/20 0.40
MAPK14 Q16539 1/20 0.39
ANPEP P15144 1/20 0.39

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
SCHEMBL8599068 1.00 KMT2A (0.50) KMT2APLGPLATLMNAALDH1A1
SCHEMBL4515125 0.89 TDP1 (0.48) ALDH1A1SMN1; SMN2TDP1HPGDMAPK14
SCHEMBL19116737 0.83 TDP1 (0.42) ALDH1A1SMN1; SMN2TDP1HPGDMAPK14
SCHEMBL11890389 0.82 EPHX1 (0.48) SMN1; SMN2KDM4ETDP1CYP2D6HPGD
SCHEMBL8598524 0.82 PLG (0.48) KMT2APLGPLATLMNAALDH1A1
SCHEMBL8598528 0.82 PLG (0.48) KMT2APLGPLATLMNAALDH1A1
SCHEMBL9575 0.81 EPHX1 (0.52) ALDH1A1SMN1; SMN2KDM4ECYP2D6HPGD
SCHEMBL8595946 0.79 KMT2A (0.59) KMT2APLGPLATLMNAALDH1A1
SCHEMBL8595943 0.79 KMT2A (0.59) KMT2APLGPLATLMNAALDH1A1
SCHEMBL916167 0.79 KMT2A (0.50) KMT2APLGPLATLMNAALDH1A1

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-0585130-B1 External preparation for skin containing a depigmentation agent SHISEIDO CO LTD (JP) 1998-01-28 EP disclosed
US-5690914-A TRANEXAMIC ACID DERIVATIVES FOR DEPIGMENTATION SHISEIDO CO., LTD (JP) 1997-11-25 US disclosed
EP-0585130-A2 External preparation for skin containing a depigmentation agent SHISEIDO COMPANY LIMITED (JP) 1994-03-02 EP disclosed