SCHEMBL8701697

SCHEMBL8701697

Cc1ccccc1CCCCC(=O)N(C)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MLYCD O95822 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
POLQ O75417 1/20 0.39
HDAC2 Q92769 2/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 2/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
GAA P10253 1/20 0.38
FASN P49327 1/20 0.38

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
SCHEMBL8695755 0.83 ALOX5 (0.63) ALOX5KMT2AMLYCDALDH1A1HDAC2
SCHEMBL8696844 0.80 PPIB (0.38) ALOX5ACHEMLYCDALDH1A1CYP4F2
SCHEMBL8696461 0.79 ALOX5 (0.56) ALOX5KMT2AMLYCDALDH1A1HDAC2
SCHEMBL8695773 0.79 ESR2 (0.40) BCHEACHEKMT2AALDH1A1KDM4E
SCHEMBL8696916 0.76 PPIB (0.39) MLYCDALDH1A1POLQHDAC2KDM4E
Trifluoroacetic Acid SCHEMBL8695772 0.76 FFAR1 (0.40) KMT2AMLYCDALDH1A1POLQKDM4E
SCHEMBL8699095 0.76 MLYCD (0.64) ALOX5MEN1KMT2AMLYCDALDH1A1
SCHEMBL22445695 0.75 MLYCD (0.46) KMT2AMLYCDALDH1A1KDM4EHPGD
SCHEMBL4253986 0.75 MAPT (0.56) ALDH1A1CYP4F2CYP4A11HDAC2HDAC1
SCHEMBL8701223 0.75 HDAC1 (0.62) ALDH1A1HDAC2HTTHDAC1

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-5726319-A Biphenyl substituted dipeptide analogs promote release of growth hormone MERCK & CO., INC. (US) 1998-03-10 US claimed