SCHEMBL6271850

SCHEMBL6271850

BrC(Br)(Br)Sc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
MAPK1 P28482 1/20 0.48
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MGLL Q99685 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.35
FFAR1 O14842 1/20 0.33
PTPN1 P18031 1/20 0.32
PTPRZ1 P23471 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
KIF11 P52732 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
SCHEMBL11640269 0.78 HPGD (0.50) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL11639651 0.78 HPGD (0.50) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL431548 0.77 MAPT (0.43) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL7529152 0.75 MAPT (0.41) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL10489143 0.73 SMN1; SMN2 (0.45) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL1143682 0.73 HPGD (0.45) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL28674848 0.73 SMN1; SMN2 (0.45) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL5922675 0.73 MAPT (0.45) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL777056 0.73 ALDH1A1 (0.56) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL1107766 0.73 MAPT (0.45) ALDH1A1MAPK1MAPTHPGDSMN1; 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
WO-2005083522-A1 PATTERN FORMING PROCESS FUJI PHOTO FILM CO., LTD. (JP) 2005-09-09 WO disclosed