SCHEMBL31464147

SCHEMBL31464147

OB(O)Oc1cc(F)cc(OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP1A2 P05177 2/20 0.46
LMNA P02545 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGS2 P35354 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HIF1A Q16665 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
MAOB P27338 4/20 0.45
FFAR1 O14842 1/20 0.44
ALOX5 P09917 1/20 0.44
ALDH1A1 P00352 1/20 0.43
RECQL P46063 1/20 0.43
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
CYP1A1 P04798 1/20 0.42
CYP19A1 P11511 1/20 0.42

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
SCHEMBL5074891 0.87 MEN1 (0.48) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL31160636 0.87 MEN1 (0.59) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL5042093 0.83 ALOX5 (0.55) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL1942638 0.82 MAOB (0.62) MEN1KMT2AMAOBALOX5ALDH1A1
SCHEMBL2504564 0.81 MEN1 (0.47) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL4770265 0.81 THRA (0.44) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL31183087 0.80 CYP1A2 (0.58) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL16886123 0.80 CYP1A2 (0.58) MEN1KMT2ACYP1A2LMNAPTGS1
SCHEMBL1373373 0.80 LMNA (0.66) CYP1A2LMNAPTGS1SLC6A2CYP2C19
SCHEMBL2226602 0.79 MAOB (0.62) MEN1KMT2ACYP1A2LMNAPTGS1

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
CN-119816484-A Novel piperazine derivative or salt thereof and pharmaceutical composition 富士胶片株式会社 2025-04-11 CN disclosed