SCHEMBL11948847

SCHEMBL11948847

Cc1cc(O)c2ccccc2c1C1NCCc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRCP P42785 5/20 0.50
GAA P10253 1/20 0.47
MAOA P21397 1/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GID4 Q8IVV7 1/20 0.44
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM1A O60341 2/20 0.43
DRD1 P21728 1/20 0.42
LMNA P02545 1/20 0.41

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
SCHEMBL11948856 0.87 PRCP (0.51) PRCPGAAMAOAMAPTMEN1
SCHEMBL11948841 0.78 PRCP (0.47) PRCPGAAMAOAMAPTMEN1
SCHEMBL6986104 0.78 PRCP (0.52) PRCPGAAMAOAMAPTMEN1
SCHEMBL4120535 0.75 PRCP (0.50) PRCPGAAMAPTMEN1KMT2A
SCHEMBL11948857 0.74 PRCP (0.55) PRCPGAAMAOAALDH1A1HSD17B10
SCHEMBL6229660 0.73 PRCP (0.65) PRCPGAAMAPTMEN1KMT2A
SCHEMBL6229072 0.73 PRCP (0.65) PRCPGAAMAPTMEN1KMT2A
SCHEMBL28801361 0.73 PRCP (0.62) PRCPGAAMAPTMEN1KMT2A
SCHEMBL11948862 0.72 PRCP (0.47) PRCPGAAMAOAMAPTRECQL
SCHEMBL11948844 0.72 PRCP (0.46) PRCPGAAMAOAGID4RECQL

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-8232399-B2 Chiral ligands, their preparation and uses thereof in asymmetric reactions Li, Chao-Jun (CA) 2012-07-31 US disclosed