SCHEMBL7443280

SCHEMBL7443280

N#Cc1ccc(N2CCN(C3CCN(C(C(=O)O)c4ccc(OCc5ccccc5)cc4)CC3)CC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.45
HRH1 P35367 2/20 0.44
CCR3 P51677 1/20 0.44
KCNH2 Q12809 1/20 0.44
FFAR1 O14842 4/20 0.43
ACACB O00763 1/20 0.43
SLC1A3 P43003 1/20 0.42
SLC1A2 P43004 1/20 0.42
MAPT P10636 4/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
KDM4E B2RXH2 2/20 0.41
RAB9A P51151 1/20 0.40
CHRM4 P08173 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2C P18825 1/20 0.40
HRH2 P25021 1/20 0.40
TMEM97 Q5BJF2 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL7435244 0.79 NPY2R (0.52) SLC1A3SLC1A2ALDH1A1LMNAKDM4E
SCHEMBL7443501 0.79 LMNA (0.46) HRH1CCR3KCNH2MAPTALDH1A1
SCHEMBL7435932 0.79 ITGB3 (0.50) FFAR1ACACBMAPTALDH1A1KDM4E
SCHEMBL7442245 0.79 KDM4E (0.44) FFAR1ACACBMAPTALDH1A1LMNA
SCHEMBL7442249 0.79 KDM4E (0.44) FFAR1ACACBMAPTALDH1A1LMNA
SCHEMBL7440141 0.78 CHRM2 (0.46) MAPTALDH1A1KDM4ECHRM4
SCHEMBL7439832 0.75 KDM4E (0.43) ALDH1A1KDM4ECHRM4
SCHEMBL7444850 0.75 NPY2R (0.42) SLC1A3SLC1A2ALDH1A1LMNAKDM4E
SCHEMBL7442787 0.74 KDM4E (0.48) KCNH2SLC1A2KDM4ECHRM4CXCR3
SCHEMBL7444975 0.74 PANK3 (0.42) SLC1A3SLC1A2ALDH1A1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623120-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-11-09 EP disclosed
WO-1993014077-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-07-22 WO disclosed