SCHEMBL9054579

SCHEMBL9054579

CSC1(SC)CCOc2cc(N)ccc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 2/20 0.41
MAP3K14 Q99558 3/20 0.36
MEN1 O00255 1/20 0.36
MITF O75030 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
APP P05067 3/20 0.34
BACE1 P56817 3/20 0.34

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
SCHEMBL9054289 0.87 MAPT (0.41) MAPTKDM4EGAAMEN1MITF
Hydrochloric Acid SCHEMBL21750681 0.86 MAPT (0.44) MAPTKDM4EGAAMEN1MITF
SCHEMBL5845932 0.81 LMNA (0.42) MAPTMAP3K14BACE1
SCHEMBL6668879 0.81 MAP3K14 (0.36) MAPTMAP3K14SMN1; SMN2ALDH1A1
SCHEMBL395807 0.78 MAPT (0.44) MAPTKDM4EGAAMAP3K14MEN1
SCHEMBL9054898 0.77 ALDH1A1 (0.42) KDM4EMAP3K14TDP1ALDH1A1
SCHEMBL3177133 0.76 ITGB2 (0.41) GAAMAP3K14KMT2ASMN1; SMN2
SCHEMBL9092261 0.75
SCHEMBL9054108 0.75
SCHEMBL4373634 0.71 LMNA (0.42) MAPTBACE1

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-5498755-A IMINE COMPOUNDS FOR SKIN DISORDERS AND ANTIINFLAMMATORY AGENTS ALLERGAN, INC. 1996-03-12 US disclosed
WO-1996006070-A1 DISUBSTITUTED ARYL AND HETEROARYL IMINES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN (US) 1996-02-29 WO disclosed