SCHEMBL4740058

SCHEMBL4740058

[CH2]c1cc(OCC=C)ccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ADRA2A P08913 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
CA12 O43570 5/20 0.44
CA1 P00915 5/20 0.44
CA9 Q16790 5/20 0.44
KAT6A Q92794 2/20 0.43
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
HPGD P15428 3/20 0.40
AGER Q15109 1/20 0.40
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
FGFR1 P11362 1/20 0.39
MAOB P27338 2/20 0.39

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
SCHEMBL27957723 0.86 MAPT (0.50) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL5987639 0.80 MAPT (0.45) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL10447991 0.80 MEN1 (0.45) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL23771636 0.77 AGER (0.53) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL22779337 0.77 CA12 (0.44) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL16956424 0.77 NQO1 (0.50) MAPTMEN1KMT2ASMN1; SMN2CA12
SCHEMBL5439339 0.76 MAPT (0.45) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL26335081 0.76 MAPT (0.49) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL21736861 0.76 ALDH1A1 (0.49) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL27548816 0.76 MEN1 (0.42) MAPTMEN1LMNAKMT2ASMN1; SMN2

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-1343775-B1 PIPERAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-06-04 EP claimed