SCHEMBL6832475

SCHEMBL6832475

CCCSNC(=O)NCC

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
FAAH O00519 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
EPHX1 P07099 5/20 0.32
KMT2A Q03164 1/20 0.32
MCL1 Q07820 1/20 0.31
KDM4A O75164 1/20 0.31

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
SCHEMBL11639597 0.87 FAAH (0.41) FAAHALDH1A1SMN1; SMN2MMP1MMP2
SCHEMBL4632344 0.85 TDP1 (0.40) TDP1EPHX1
SCHEMBL9665506 0.84 FAAH (0.47) FAAHEPHX1
SCHEMBL11529423 0.83 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2MMP1MMP2MMP3
SCHEMBL9555587 0.79
SCHEMBL9664876 0.73
SCHEMBL9555829 0.72 ALDH1A1 (0.32) FAAHALDH1A1SMN1; SMN2MMP1MMP2
SCHEMBL29313232 0.71
SCHEMBL4630334 0.71 EPHX1 (0.39) ALDH1A1EPHX1
SCHEMBL1099068 0.71

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
US-20040137389-A1 Heat-developable light-sensitive material FUJIFILM CORPORATION (JP) 2004-07-15 US disclosed
US-5246688-A Heating aqueous homogeneous reaction mixture comprising fluosilicate, reagent providing hydroxide ions by hydrothermal decomposition, structuring agent; separating precipitate, calcining RHONE-POULENC CHIMIE (FR) 1993-09-21 US disclosed