SCHEMBL9168932

SCHEMBL9168932

CCOc1c(Cl)cccc1C(O)C(C)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
AOC3 Q16853 1/20 0.38
NISCH Q9Y2I1 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CASP1 P29466 1/20 0.36
FABP4 P15090 2/20 0.35
FABP5 Q01469 2/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 2/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
MEN1 O00255 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ADRA2A P08913 2/20 0.34
ADRA2B P18089 2/20 0.34
ADRA2C P18825 2/20 0.34
HTR1A P08908 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL8617618 0.78 AOC3 (0.49) KDM4EL3MBTL1AOC3CASP1KMT2A
SCHEMBL21668015 0.77 L3MBTL1 (0.46) KDM4EALDH1A1L3MBTL1CASP1LMNA
SCHEMBL9168925 0.75 CFD (0.46) KDM4EALDH1A1L3MBTL1AOC3SMN1; SMN2
SCHEMBL16957110 0.74 L3MBTL1 (0.44) KDM4EALDH1A1L3MBTL1SMN1; SMN2CASP1
SCHEMBL1547567 0.73 L3MBTL1 (0.59) KDM4EALDH1A1L3MBTL1SMN1; SMN2LMNA
SCHEMBL16961193 0.71 L3MBTL1 (0.41) KDM4EALDH1A1L3MBTL1CASP1FABP4
SCHEMBL3329675 0.70 L3MBTL1 (0.49) KDM4EALDH1A1L3MBTL1SMN1; SMN2LMNA
SCHEMBL2525928 0.70 L3MBTL1 (0.62) KDM4EALDH1A1L3MBTL1LMNAKMT2A
SCHEMBL16959279 0.69 L3MBTL1 (0.42) KDM4EALDH1A1L3MBTL1SMN1; SMN2CASP1
SCHEMBL16950580 0.68 L3MBTL1 (0.41) KDM4EALDH1A1L3MBTL1SMN1; SMN2CASP1

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-0651735-A1 PHARMACOLOGICALLY ACTIVE ALPHA-(TERTIARY-AMINOMETHYL)-PHENYLMETHANOL DERIVATIVES Pharmacia & Upjohn Aktiebolag (SE) 1995-05-10 EP disclosed