SCHEMBL6565570

SCHEMBL6565570

Cc1c(N)ccc(N)c1CCNS(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
NQO2 P16083 1/20 0.41
ALDH1A1 P00352 5/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALOX15 P16050 1/20 0.38
RECQL P46063 2/20 0.37
HTT P42858 1/20 0.36
GFER P55789 1/20 0.35
GRIA4 P48058 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MTNR1A P48039 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL6535868 0.84 LMNA (0.38) POLBNQO2ALDH1A1MAPTKDM4E
SCHEMBL5692631 0.82 GAA (0.36) POLBNQO2ALDH1A1MAPTKDM4E
SCHEMBL5692535 0.82 GAA (0.36) POLBNQO2ALDH1A1MAPTKDM4E
Sulfuric Acid SCHEMBL6683793 0.80 MAPT (0.36) POLBNQO2ALDH1A1MAPTKDM4E
Sulfuric Acid SCHEMBL9614826 0.79 MAPT (0.35) POLBNQO2ALDH1A1MAPTKDM4E
SCHEMBL5162051 0.78 NQO2 (0.32) POLBNQO2ALDH1A1MAPTKDM4E
SCHEMBL10351630 0.76
Sulfuric Acid SCHEMBL8777212 0.76 HCAR3 (0.31) GRIA4
Sulfuric Acid SCHEMBL9796893 0.75 NQO2 (0.41) POLBNQO2ALDH1A1MAPTKDM4E
SCHEMBL10830090 0.73 ALDH1A1 (0.33) POLBALDH1A1MAPTRECQLHTT

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-1399780-A1 METHOD FOR PURIFYING FREE-BASE P-PHENYLENEDIAMINE-TYPE PHOTOGRAPHIC COLOR DEVELOPERS EASTMAN CHEMICAL COMPANY (US) 2004-03-24 EP disclosed
WO-2003003115-A1 METHOD FOR PURIFYING FREE-BASE P-PHENYLENEDIAMINE-TYPE PHOTOGRAPHIC COLOR DEVELOPERS EASTMAN CHEMICAL COMPANY (US) 2003-01-09 WO disclosed