SCHEMBL4580177

SCHEMBL4580177

CCOP(=O)(OCC)c1ccc(C(=O)c2ccc(F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
LTA4H P09960 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MAOB P27338 1/20 0.40
HTR7 P34969 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
CASP3 P42574 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
HDAC1 Q13547 2/20 0.40
HPGD P15428 3/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 2/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 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
SCHEMBL895236 0.88 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ALMNAGAA
SCHEMBL578264 0.83 ALDH1A1 (0.46) ALDH1A1LTA4HMEN1KMT2ALMNA
SCHEMBL2207123 0.80 MEN1 (0.50) ALDH1A1LTA4HMEN1KMT2ASMN1; SMN2
SCHEMBL6829825 0.78 TDP1 (0.49) LTA4HMEN1KMT2ATP53
SCHEMBL11055062 0.77 MAPT (0.53) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL5663123 0.77 MEN1 (0.69) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL2322449 0.74 HTR7 (0.47) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL12229756 0.74 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL12012734 0.73 LMNA (0.48) ALDH1A1LTA4HMEN1KMT2ALMNA
SCHEMBL779299 0.73 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ALMNAGAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459505-B2 Block copolymers with acidic groups GENERAL MOTORS CORPORATION (US) 2008-12-02 US disclosed
US-7459505-B2 Block copolymers with acidic groups GENERAL MOTORS CORPORATION (US) 2008-12-02 US disclosed
US-20060251969-A1 Block copolymers with acidic groups GM GLOBAL TECHNOLOGY OPERATIONS, INC. (US) 2006-11-09 US disclosed