SCHEMBL16675212

SCHEMBL16675212

CCc1nnc(-c2cc(-c3nnc(CC)o3)cc(-c3nnc(CC)o3)c2)o1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.43
NOTUM Q6P988 3/20 0.42
POLB P06746 3/20 0.42
TSHR P16473 2/20 0.42
USP2 O75604 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
GPR55 Q9Y2T6 1/20 0.41
KMT2A Q03164 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPK14 Q16539 1/20 0.39
LRRK2 Q5S007 1/20 0.38
ALOX12 P18054 1/20 0.38
TP53 P04637 1/20 0.37

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
SCHEMBL13621248 0.86 KDM4E (0.40) ALDH1A1SMN1; SMN2KDM4EMAPTNOTUM
SCHEMBL8235977 0.81 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2KDM4EMAPTNOTUM
SCHEMBL8050653 0.78 PTGS2 (0.52) ALDH1A1SMN1; SMN2MAPTNOTUMPOLB
SCHEMBL13572955 0.78 TSHR (0.73) SMN1; SMN2KDM4EMAPTPOLBTSHR
SCHEMBL14438048 0.78 KMT2A (0.62) ALDH1A1SMN1; SMN2KDM4EMAPTNOTUM
SCHEMBL1148123 0.78 MAPT (0.45) ALDH1A1SMN1; SMN2KDM4EMAPTNOTUM
SCHEMBL3032013 0.78 MAPT (0.49) ALDH1A1SMN1; SMN2KDM4EMAPTNOTUM
SCHEMBL7260633 0.78 NPC1 (0.64) ALDH1A1SMN1; SMN2KDM4EMAPTNOTUM
SCHEMBL8058379 0.77 LMNA (0.50) ALDH1A1SMN1; SMN2MAPTNOTUMPOLB
SCHEMBL2288774 0.77 APP (0.51) ALDH1A1SMN1; SMN2NOTUMPOLBTSHR

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-20150114257-A1 METHOD OF PREPARING RETARDATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY Konica Minolta, Inc. (JP) 2015-04-30 US disclosed
US-20150114257-A1 METHOD OF PREPARING RETARDATION FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY Konica Minolta, Inc. (JP) 2015-04-30 US disclosed