SCHEMBL8633909

SCHEMBL8633909

Nc1ccc(-c2ccc(Nc3nc(S)nc(S)n3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.44
RAD52 P43351 1/20 0.42
TXN P10599 1/20 0.42
IKBKB O14920 1/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.41
TP53 P04637 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 4/20 0.41
HTT P42858 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX12 P18054 1/20 0.41
CYP2C19 P33261 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
VCP P55072 1/20 0.39
ALOX5 P09917 1/20 0.39
KDM1A O60341 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 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
SCHEMBL9475009 0.94 SYK (0.47) SYKRAD52IKBKBALDH1A1CYP3A4
SCHEMBL7512302 0.80 RAD52 (0.56) SYKRAD52ALDH1A1CYP3A4TP53
SCHEMBL22214935 0.78 TXN (0.69) SYKTXNMAPTVCPCA12
SCHEMBL6301188 0.75 MAPT (0.67) SYKRAD52ALDH1A1CYP3A4TP53
SCHEMBL351125 0.75 MAPT (0.67) SYKRAD52ALDH1A1CYP3A4TP53
SCHEMBL9518383 0.75 MAPT (0.67) SYKRAD52ALDH1A1CYP3A4TP53
SCHEMBL16628855 0.75 MAPK1 (0.54) IKBKBALDH1A1CYP3A4TP53TDP1
SCHEMBL8629687 0.75 POLB (0.50) TXNALDH1A1TP53MAPTALOX12
SCHEMBL11615704 0.75 RAB9A (0.49) ALDH1A1CYP3A4MAPTHTTCYP1A2
SCHEMBL1152315 0.74 MAPT (0.57) IKBKBALDH1A1TP53TDP1MAPT

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-0508390-B1 Light-sensitive silver halide photographic material KONISHIROKU PHOTO IND (JP) 1998-07-01 EP disclosed
US-5258280-A 2-amino-4,6-dimercapto-1,3,5-triazine derivatives; blackness, high covering power KONICA CORPORATION (JP) 1993-11-02 US disclosed
EP-0508390-A2 Light-sensitive silver halide photographic material KONICA CORPORATION (JP) 1992-10-14 EP disclosed