SCHEMBL7443501

SCHEMBL7443501

N#Cc1ccc(N2CCN(C3CCN(C(Cc4ccccc4)C(=O)O)CC3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
HRH1 P35367 2/20 0.45
CCR3 P51677 2/20 0.45
KCNH2 Q12809 2/20 0.45
KDM4E B2RXH2 4/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CHRM4 P08173 2/20 0.45
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
ALOX15 P16050 1/20 0.43
CCR5 P51681 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
CXCR4 P61073 1/20 0.42
THRB P10828 1/20 0.42
PRKAA2 P54646 1/20 0.42
HTT P42858 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
SCHEMBL9314052 0.92 CHRM4 (0.42) LMNAHRH1CCR3KCNH2KDM4E
SCHEMBL7435280 0.82 ITGB3 (0.61) LMNAKDM4ECYP2C9CYP2C19MAPT
SCHEMBL7443280 0.79 MAOB (0.45) LMNAHRH1CCR3KCNH2KDM4E
Trifluoroacetic Acid SCHEMBL7443965 0.79 ITGB3 (0.56) LMNAKDM4ECYP2C9CYP2C19ALDH1A1
SCHEMBL7435155 0.77 CTSS (0.42) KDM4ECYP2C9CYP2C19MAPTALDH1A1
SCHEMBL7435244 0.76 NPY2R (0.52) LMNAKDM4ECYP2C9CYP2C19CHRM4
SCHEMBL7337863 0.74 KDM4E (0.46) LMNAKDM4ECYP2C9CYP2C19MAPT
SCHEMBL5800431 0.74 KDM4E (0.61) KDM4EL3MBTL1
SCHEMBL7444913 0.73 ESR1 (0.46) LMNAKDM4ECYP2C9CYP2C19CHRM4
SCHEMBL7435921 0.73 ITGB3 (0.59) KDM4ECYP2C9CYP2C19MAPTALDH1A1

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