SCHEMBL3929665

SCHEMBL3929665

CCOC(=O)C(Cc1ccc(O)cc1)Nc1cccc2cccnc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
POLB P06746 2/20 0.46
HDAC3 O15379 3/20 0.45
HDAC1 Q13547 3/20 0.45
HDAC2 Q92769 3/20 0.45
HDAC6 Q9UBN7 3/20 0.45
MEN1 O00255 2/20 0.45
KDR P35968 1/20 0.45
LMNA P02545 2/20 0.44
MMP14 P50281 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
BACE1 P56817 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
MAPT P10636 2/20 0.43

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
SCHEMBL3929661 1.00 KMT2A (0.46) KMT2APOLBHDAC3HDAC1HDAC2
SCHEMBL3927035 0.81 BACE1 (0.54) KMT2APOLBMEN1LMNASMN1; SMN2
SCHEMBL6712976 0.74 BACE1 (0.54) POLBALDH1A1TP53BACE1ELANE
SCHEMBL11014735 0.74 BACE1 (0.54) POLBALDH1A1TP53BACE1ELANE
SCHEMBL4159916 0.73 PPARG (0.61)
SCHEMBL7956801 0.72 EGLN1 (0.57) ALDH1A1GAA
SCHEMBL7956796 0.72 EGLN1 (0.57) ALDH1A1GAA
SCHEMBL1011405 0.72 KMT2A (0.63) KMT2APOLBMEN1KDRLMNA
SCHEMBL3938112 0.72 GRIA1 (0.56) KDRSMN1; SMN2KDM4EBACE1GAA
SCHEMBL12004867 0.72 GRIA1 (0.56) KDRSMN1; SMN2KDM4EBACE1GAA

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