SCHEMBL19263307

SCHEMBL19263307

O=C(OCc1cc(-c2ccccc2)no1)C1=CC=CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
RAB9A P51151 10/20 0.49
NPC1 O15118 8/20 0.49
SMN1; SMN2 Q16637 8/20 0.49
L3MBTL1 Q9Y468 5/20 0.49
TDP1 Q9NUW8 3/20 0.49
POLB P06746 2/20 0.47
NOTUM Q6P988 2/20 0.47
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
CHRM3 P20309 1/20 0.42
HPGD P15428 1/20 0.42
STAT3 P40763 1/20 0.42
STAT1 P42224 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 2/20 0.41
CYP11B1 P15538 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
SCHEMBL19263008 0.90 MAPT (0.45) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263274 0.90 MAPT (0.45) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263276 0.89 MAPT (0.45) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263012 0.89 MAPT (0.44) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263284 0.89 POLB (0.53) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263270 0.89 NPC1 (0.46) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263265 0.87 MAPT (0.44) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263234 0.87 MAPT (0.43) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263005 0.87 MAPT (0.43) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL19263251 0.86 PPARD (0.45) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1

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-9738673-B1 Ferrocene derivative, preparation method and use thereof XIAMEN INSTITUTE OF RARE EARTH MATERIALS (CN) 2017-08-22 US disclosed