SCHEMBL6475705

SCHEMBL6475705

CCN(CC)c1ccc(CCCN(c2ccccc2)c2ccccc2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
NFKB1 P19838 2/20 0.42
GMNN O75496 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP2D6 P10635 1/20 0.42
GABRA1 P14867 1/20 0.42
TSHR P16473 1/20 0.42
THPO P40225 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42
PMP22 Q01453 1/20 0.42
HIF1A Q16665 1/20 0.42
SLCO1B3 Q9NPD5 1/20 0.42
NPC1 O15118 2/20 0.42

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
SCHEMBL6476542 0.91 MEN1 (0.45) CNR2MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL4249115 0.79 NPC1 (0.50) MEN1KMT2ALMNAALDH1A1TSHR
SCHEMBL11689679 0.79 NPC1 (0.50) MEN1KMT2ALMNAALDH1A1TSHR
SCHEMBL4897611 0.78 TP53 (0.47) ALDH1A1TSHRLTB4R2TP53
SCHEMBL6474913 0.74 MEN1 (0.55) MEN1KMT2ASMN1; SMN2LMNAMAPT
SCHEMBL1668024 0.73 TP53 (0.53) MEN1KMT2ASMN1; SMN2L3MBTL1MAPT
SCHEMBL14174039 0.73 CNR2 (0.67) CNR2TSHRAOC3CHRM2HTR1A
SCHEMBL11690630 0.72 LTB4R2 (0.48) CNR2SMN1; SMN2LMNAALDH1A1TSHR
SCHEMBL6475710 0.72 CLCN2 (0.49) CNR2MEN1KMT2ASMN1; SMN2L3MBTL1
SCHEMBL28860869 0.72 TSHR (0.58) CNR2MEN1KMT2ASMN1; 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-6972287-B1 Method of inhibiting amyloid protein aggregation and imaging amyloid deposits PFIZER INC. (US) 2005-12-06 US claimed