SCHEMBL8595703

SCHEMBL8595703

O=C(NC[C@H]1CC[C@H](C(=O)O)CC1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
PLG P00747 1/20 0.46
PLAT P00750 1/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MMP12 P39900 5/20 0.42
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
EPHX1 P07099 1/20 0.38
MLYCD O95822 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ANPEP P15144 1/20 0.38
ENPEP Q07075 1/20 0.38

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
SCHEMBL8596354 1.00 KMT2A (0.46) KMT2APLGPLATLMNATDP1
SCHEMBL9431190 0.89 TDP1 (0.52) KMT2ATDP1SMN1; SMN2CKS1BSKP1
SCHEMBL8598629 0.84 KMT2A (0.54) KMT2APLGPLATLMNATDP1
SCHEMBL8598622 0.84 KMT2A (0.54) KMT2APLGPLATLMNATDP1
SCHEMBL3381027 0.81 HDAC6 (0.53) KMT2ATDP1SMN1; SMN2CKS1BSKP1
SCHEMBL3383177 0.81 HDAC6 (0.49) KMT2ATDP1SMN1; SMN2CKS1BSKP1
SCHEMBL4765060 0.80 TDP1 (0.48) KMT2ATDP1SMN1; SMN2CKS1BSKP1
SCHEMBL4380418 0.80 TDP1 (0.48) KMT2ATDP1SMN1; SMN2CKS1BSKP1
SCHEMBL2955171 0.80 TDP1 (0.48) KMT2ATDP1SMN1; SMN2CKS1BSKP1
SCHEMBL3379859 0.79 HDAC6 (0.55) KMT2ATDP1SMN1; SMN2ALDH1A1POLB

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