SCHEMBL9615469

SCHEMBL9615469

CCN(CO)c1ccc(N)c(C)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100B P04271 1/20 0.79
S1PR1 P21453 6/20 0.44
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 4/20 0.42
MAPK1 P28482 3/20 0.42
GFER P55789 3/20 0.42
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
PSMD14 O00487 1/20 0.42
RECQL P46063 1/20 0.42
ESR1 P03372 2/20 0.40
AR P10275 1/20 0.40
ESR2 Q92731 1/20 0.40
SKP2 Q13309 1/20 0.40
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
ALOX15 P16050 1/20 0.38
KMT2A Q03164 1/20 0.38
TERT O14746 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
SCHEMBL29350181 0.89 S100B (1.00) S100BS1PR1ALDH1A1CYP3A4MAPK1
SCHEMBL34104 0.89 S100B (1.00) S100BS1PR1ALDH1A1CYP3A4MAPK1
Hypochlorous Acid SCHEMBL6550511 0.87 S100B (0.89) S100BS1PR1ALDH1A1CYP3A4MAPK1
Hydrochloric Acid SCHEMBL2136137 0.87 S100B (0.96) S100BS1PR1ALDH1A1CYP3A4MAPK1
Hydrochloric Acid SCHEMBL3385174 0.87 S100B (0.96) S100BS1PR1ALDH1A1CYP3A4MAPK1
SCHEMBL793452 0.86 S100B (0.74) S100BS1PR1ALDH1A1CYP3A4MAPK1
SCHEMBL29354848 0.86 S100B (0.74) S100BS1PR1ALDH1A1CYP3A4MAPK1
SCHEMBL33702 0.85 S100B (0.85) S100BS1PR1ALDH1A1CYP3A4MAPK1
SCHEMBL29381855 0.85 S100B (0.85) S100BS1PR1ALDH1A1CYP3A4MAPK1
Hydrochloric Acid SCHEMBL28014084 0.85 S100B (0.92) S100BS1PR1ALDH1A1CYP3A4MAPK1

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-5158892-A Antifogging agent FUJI PHOTO FILM CO., LTD. (JP) 1992-10-27 US disclosed
US-4791048-A Color image forming process utilizing substantially water-insoluble basic metal compounds and complexing compounds FUJI PHOTO FILM CO., LTD. (JP) 1988-12-13 US disclosed