SCHEMBL10270622

SCHEMBL10270622

CCCC(N)n1c(S)nc2nc3ccccc3nc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.41
ALDH1A1 P00352 12/20 0.41
HPGD P15428 9/20 0.41
CASP1 P29466 9/20 0.41
CASP7 P55210 9/20 0.41
GAA P10253 8/20 0.41
HSD17B10 Q99714 8/20 0.41
GLA P06280 5/20 0.41
MAPT P10636 8/20 0.39
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 5/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36

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
SCHEMBL1104435 0.69 KDM4E (0.42) KDM4EALDH1A1HPGDCASP1CASP7
SCHEMBL16329007 0.69 TLR8 (0.47) KDM4EALDH1A1GLAMAPTSMN1; SMN2
SCHEMBL14153562 0.66 POLB (0.41) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL13396393 0.66 KDM4E (0.43) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL978893 0.65 KDM4E (0.47) KDM4EALDH1A1HPGDCASP1CASP7
SCHEMBL6427185 0.60 SLC9A1 (0.50) ALDH1A1MAPTCYP1A2CYP2D6CYP2C9
SCHEMBL14048505 0.59 SMN1; SMN2 (0.44) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL13446947 0.59 TLR8 (0.41) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL9437426 0.59 KDM4E (0.49) KDM4EALDH1A1HPGDCASP1CASP7
SCHEMBL5305100 0.58 TLR7 (0.50) KDM4EALDH1A1HPGDCASP1CASP7

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
US-8151705-B2 Method of preparing lithographic printing plate FUJIFILM CORPORATION (JP) 2012-04-10 US disclosed
US-20110017084-A1 IMMERSION TYPE AUTOMATIC DEVELOPING APPARATUS FOR LITHOGRAPHIC PRINTING PLATE AND AUTOMATIC DEVELOPING METHOD FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed
US-20100081771-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2010-04-01 US disclosed