SCHEMBL9766627

SCHEMBL9766627

CCCCCc1ccc(CCc2ccc(Cl)nc2)cc1.CCCCc1ccc(CCc2ccc(Cl)nc2)cc1.CCCc1ccc(CCc2ccc(Cl)nc2)cc1.CCc1ccc(CCc2ccc(Cl)nc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
L3MBTL1 Q9Y468 5/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
NFKB1 P19838 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 2/20 0.43
CYP3A4 P08684 2/20 0.43
HIF1A Q16665 2/20 0.43
CYP1A2 P05177 1/20 0.43
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
THPO P40225 1/20 0.43
BLM P54132 1/20 0.43
PMP22 Q01453 1/20 0.43
RAB9A P51151 6/20 0.43
SMN1; SMN2 Q16637 4/20 0.43

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
SCHEMBL9158692 0.91 MAPT (0.49) MAPTL3MBTL1KDM4EALDH1A1NFKB1
SCHEMBL9158922 0.89 NFKB1 (0.51) MAPTL3MBTL1KDM4EALDH1A1NFKB1
SCHEMBL594105 0.87 RAB9A (0.51) MAPTL3MBTL1KDM4EALDH1A1NFKB1
SCHEMBL21469023 0.86 MAPT (0.54) MAPTL3MBTL1KDM4EALDH1A1NFKB1
SCHEMBL9850747 0.86 MAPT (0.54) MAPTL3MBTL1KDM4EALDH1A1NFKB1
SCHEMBL9159976 0.86 MAPT (0.49) MAPTL3MBTL1KDM4EALDH1A1LMNA
SCHEMBL9319296 0.86 MAPT (0.54) MAPTL3MBTL1KDM4EALDH1A1NFKB1
SCHEMBL9157673 0.86 ALDH1A1 (0.46) MAPTL3MBTL1KDM4EALDH1A1LMNA
SCHEMBL9766645 0.85 FFAR1 (0.52) MAPTL3MBTL1KDM4EALDH1A1MEN1
SCHEMBL6788044 0.82 ALDH1A1 (0.49) MAPTL3MBTL1KDM4EALDH1A1LMNA

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
EP-0445248-A1 PYRIDINE DERIVATIVES. MERCK PATENT GMBH (DE) 1991-09-11 EP disclosed