SCHEMBL8995469

SCHEMBL8995469

O=[C]c1ccc(OCCn2cncn2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.68
ALDH1A1 P00352 6/20 0.68
MAPT P10636 4/20 0.68
LMNA P02545 3/20 0.62
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
KDM4E B2RXH2 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
TP53 P04637 3/20 0.56
TSHR P16473 1/20 0.56
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
ALOX15 P16050 1/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL8995256 0.93 MAPT (0.66) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL8995367 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL8995473 0.82 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL10784148 0.81 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL16358260 0.81 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL5655457 0.81 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL13246375 0.81 SMN1; SMN2 (0.77) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL5656114 0.78 SMN1; SMN2 (0.63) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL10932701 0.77 SMN1; SMN2 (0.62) SMN1; SMN2ALDH1A1MAPTLMNANPC1
SCHEMBL8995270 0.75 MAPT (0.66) SMN1; SMN2ALDH1A1MAPTLMNANPC1

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-5496844-A Indole derivatives OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1996-03-05 US disclosed
EP-0639567-A1 INDOLE DERIVATIVE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1995-02-22 EP disclosed