SCHEMBL3932010

SCHEMBL3932010

CCOC(=O)C(Cc1ccc(OC)cc1)NC(=O)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.67
RAB9A P51151 1/20 0.67
CTSL P07711 5/20 0.58
PTPN1 P18031 1/20 0.58
HDAC3 O15379 1/20 0.57
HDAC4 P56524 1/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC7 Q8WUI4 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC10 Q969S8 1/20 0.57
HDAC11 Q96DB2 1/20 0.57
HDAC8 Q9BY41 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
HDAC9 Q9UKV0 1/20 0.57
HDAC5 Q9UQL6 1/20 0.57
CA2 P00918 1/20 0.57
EPHX2 P34913 1/20 0.55
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
GLA P06280 1/20 0.53

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
SCHEMBL3932008 1.00 GAA (0.67) GAARAB9ACTSLPTPN1HDAC3
SCHEMBL28790851 0.90 CTSL (0.71) GAARAB9ACTSLEPHX2ALDH1A1
SCHEMBL3927028 0.90 CTSL (0.71) GAARAB9ACTSLEPHX2ALDH1A1
SCHEMBL6519512 0.89 EPHX2 (0.56) GAARAB9ACTSLPTPN1HDAC3
SCHEMBL27761117 0.88 CTSL (0.62) GAARAB9ACTSLHDAC1HDAC6
SCHEMBL1784498 0.87 CTSL (0.62) GAARAB9ACTSLCA2ALDH1A1
SCHEMBL1796825 0.87 CTSL (0.62) GAARAB9ACTSLCA2ALDH1A1
SCHEMBL3935180 0.87 CTSL (0.62) GAARAB9ACTSLCA2ALDH1A1
SCHEMBL30064651 0.87 CTSL (0.62) GAARAB9ACTSLCA2ALDH1A1
SCHEMBL9461988 0.87 PTPN1 (0.73) GAARAB9APTPN1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1691199-B1 METHOD OF PREDICTING SPOT FORMATION ON THE SKIN WITH THE USE OF SPOT SITE-ACCELERATING GENES AS INDICATION AND METHOD OF SCREENING INHIBITOR FOR SPOT FORMATION ON THE SKIN SHISEIDO CO LTD (JP) 2009-04-01 EP disclosed
EP-1691199-A1 METHOD OF PREDICTING SPOT FORMATION ON THE SKIN WITH THE USE OF SPOT SITE-ACCELERATING GENES AS INDICATION AND METHOD OF SCREENING INHIBITOR FOR SPOT FORMATION ON THE SKIN SHISEIDO COMPANY LIMITED (JP) 2006-08-16 EP disclosed