SCHEMBL9118023

SCHEMBL9118023

CCN(CCCNS(C)(=O)=O)c1ccc(N)c(C)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S100B P04271 1/20 0.57
▸ ALDH1A1 P00352 6/20 0.38
▸ MAPT P10636 5/20 0.38
▸ HPGD P15428 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GAA P10253 3/20 0.37
▸ GFER P55789 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ KMT2A Q03164 4/20 0.35
▸ POLB P06746 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ GRK2 P25098 1/20 0.35
▸ DNMT1 P26358 1/20 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
SCHEMBL2157605 0.93 S100B (0.62) S100BALDH1A1MAPTHPGDTSHR
Water SCHEMBL9381945 0.92 S100B (0.60) S100BALDH1A1MAPTTSHRGAA
Hydrochloric Acid SCHEMBL8744829 0.92 S100B (0.60) S100BALDH1A1MAPTTSHRGAA
SCHEMBL8770564 0.90 S100B (0.55) S100BALDH1A1MAPTHPGDTSHR
Sulfuric Acid SCHEMBL6479893 0.90 S100B (0.57) S100BALDH1A1MAPTHPGDTSHR
Sulfuric Acid SCHEMBL10900457 0.90 S100B (0.57) S100BALDH1A1MAPTHPGDTSHR
Sulfuric Acid SCHEMBL4912919 0.90 S100B (0.57) S100BALDH1A1MAPTHPGDTSHR
Sulfuric Acid SCHEMBL2138908 0.89 S100B (0.56) S100BALDH1A1MAPTHPGDTSHR
Sulfuric Acid SCHEMBL5809892 0.89 S100B (0.56) S100BALDH1A1MAPTHPGDTSHR
Bicarbonate SCHEMBL9231318 0.88 S100B (0.55) S100BALDH1A1MAPTTSHRSMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5455146-A Method for forming color image FUJI PHOTO FILM CO., LTD. (JP) 1995-10-03 — — US disclosed
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