SCHEMBL4766135

SCHEMBL4766135

Cc1ccc(N2CCN(C(=O)c3cccnc3F)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
MAPK1 P28482 1/20 0.57
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HTT P42858 2/20 0.52
LMNA P02545 2/20 0.52
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.51
TSHR P16473 1/20 0.51
KMT2A Q03164 1/20 0.51
SLC6A7 Q99884 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TYR P14679 1/20 0.49

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
SCHEMBL8247070 0.90 SMN1; SMN2 (0.72) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL4722869 0.87 AKR1C3 (0.58) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL4722909 0.86 GAA (0.60) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL4722493 0.85 SMN1; SMN2 (0.54) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL8247829 0.84 USP2 (0.53) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL4718989 0.82 ALDH1A1 (0.53) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL4719103 0.81 ABL1 (0.55) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL8246614 0.80 ALDH1A1 (0.62) SMN1; SMN2ALDH1A1HTTLMNAMAPT
SCHEMBL8247543 0.79 MEN1 (0.58) USP2SMN1; SMN2MAPK1KDM4EALDH1A1
SCHEMBL4722342 0.77 MEN1 (0.71) SMN1; SMN2MAPK1KDM4EALDH1A1L3MBTL1

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-1907363-A1 PHENYL SUBSTITUTED PIPERAZINE-DERIVATIVES AS INHIBITORS OF PLAMINOGENIC ACTIVATOR INHIBITORS-I (PAI-I) Bayer HealthCare AG (DE) 2008-04-09 EP disclosed
WO-2007009635-A1 PHENYL SUBSTITUTED PIPERAZINE-DERIVATIVES AS INHIBITORS OF PLAMINOGENIC ACTIVATOR INHIBITORS-I (PAI-I) BAYER HEALTHCARE AG (DE) 2007-01-25 WO disclosed
WO-2007009635-A1 PHENYL SUBSTITUTED PIPERAZINE-DERIVATIVES AS INHIBITORS OF PLAMINOGENIC ACTIVATOR INHIBITORS-I (PAI-I) BAYER HEALTHCARE AG (DE) 2007-01-25 WO disclosed