SCHEMBL9555458

SCHEMBL9555458

CCN(CC)c1ccc(N)c(C(C)S(=O)(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100B P04271 1/20 0.49
ALDH1A1 P00352 12/20 0.42
MEN1 O00255 8/20 0.42
KMT2A Q03164 8/20 0.42
L3MBTL1 Q9Y468 7/20 0.42
HPGD P15428 4/20 0.42
HSP90AA1 P07900 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPK1 P28482 3/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
RECQL P46063 2/20 0.40
PSMD14 O00487 1/20 0.40
GFER P55789 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TERT O14746 1/20 0.36
MAPT P10636 6/20 0.36
CNR2 P34972 1/20 0.35
HSD17B10 Q99714 2/20 0.35

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
Sulfuric Acid SCHEMBL10336891 0.80 S100B (0.43) S100BALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL8745520 0.80 S100B (0.56) S100BALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL9555372 0.78 S100B (0.50) S100BALDH1A1MEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL10715600 0.77 S100B (0.46) S100BALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL5156281 0.77 S100B (0.46) S100BALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL6849087 0.77 S100B (0.46) S100BALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL7093725 0.77 S100B (0.46) S100BALDH1A1MEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL4581646 0.76 S100B (0.45) S100BALDH1A1MEN1KMT2AL3MBTL1
Hydrochloric Acid SCHEMBL11576846 0.76 S100B (0.45) S100BALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL9658374 0.76 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AL3MBTL1HPGD

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-5200302-A Applying a color developer comprising a p-phenylenediamine developing agent to form a thin film FUJI PHOTO FILM CO., LTD. (JP) 1993-04-06 US claimed
US-5200302-A Applying a color developer comprising a p-phenylenediamine developing agent to form a thin film FUJI PHOTO FILM CO., LTD. (JP) 1993-04-06 US disclosed