SCHEMBL19332575

SCHEMBL19332575

CC(C)n1ccc2ccc(Br)cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PSMB1 P20618 3/20 0.49
PSMB5 P28074 3/20 0.49
TYMS P04818 2/20 0.37
PDE4B Q07343 1/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 1/20 0.36
DPP4 P27487 1/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
MIF P14174 1/20 0.34
CASP3 P42574 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MCL1 Q07820 1/20 0.33
ATM Q13315 1/20 0.33
HTR7 P34969 1/20 0.33

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
SCHEMBL31559172 1.00 PSMB1 (0.49) PSMB1PSMB5TYMSPDE4BHTR2A
SCHEMBL1500297 0.87 HTR2A (0.39) PSMB1PSMB5PDE4BHTR2AHTR2C
SCHEMBL25910676 0.80 HTR2C (0.39) TYMSHTR2AHTR2CMIF
SCHEMBL16166662 0.80 BRPF1 (0.37) PSMB1PSMB5TYMSHTR2AALDH1A1
SCHEMBL28592437 0.80 PIM1 (0.39) TYMSHTR2AHTR2CDPP4ALDH1A1
SCHEMBL23775716 0.80 RORA (0.36) PSMB1PSMB5HTR2AALDH1A1HTT
SCHEMBL30033880 0.80 PIM1 (0.39) TYMSHTR2AHTR2CDPP4ALDH1A1
SCHEMBL30349862 0.80 BRPF1 (0.37) PSMB1PSMB5TYMSHTR2AALDH1A1
SCHEMBL9919029 0.77 PSMB1 (0.46) PSMB1PSMB5TYMSLMNAMIF
SCHEMBL2117453 0.76 HDAC6 (0.41) PSMB1PSMB5

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
EP-3426260-A1 C-GLYCOSIDE COMPOUNDS USEFUL FOR TREATING DISEASE Fimbrion Therapeutics, Inc. (US) 2019-01-16 EP disclosed
WO-2017156508-A1 C-GLYCOSIDE COMPOUNDS USEFUL FOR TREATING DISEASE FIMBRION THERAPEUTICS, INC. (US) 2017-09-14 WO disclosed
WO-2017156508-A1 C-GLYCOSIDE COMPOUNDS USEFUL FOR TREATING DISEASE FIMBRION THERAPEUTICS, INC. (US) 2017-09-14 WO disclosed