SCHEMBL6152745

SCHEMBL6152745

CNC(=O)CCC(=O)CN

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
LMNA P02545 2/20 0.52
GABRR1 P24046 1/20 0.50
POLB P06746 1/20 0.39
KDM5C P41229 3/20 0.39
PHF8 Q9UPP1 3/20 0.39
KDM2A Q9Y2K7 3/20 0.39
EGLN1 Q9GZT9 2/20 0.39
HTR2C P28335 1/20 0.37
MCL1 Q07820 1/20 0.36
KDM6B O15054 1/20 0.36
ALDH1A1 P00352 1/20 0.33
CTSD P07339 1/20 0.32
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
EGFR P00533 1/20 0.30
SRC P12931 1/20 0.30

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
SCHEMBL3660629 0.81 LMNA (0.63) KDM4ELMNAPOLBKDM5CPHF8
SCHEMBL4093803 0.77 LMNA (0.48) KDM4ELMNAPOLBKDM5CPHF8
SCHEMBL26384671 0.77 KDM4E (0.56) KDM4ELMNAGABRR1POLBKDM5C
SCHEMBL429273 0.76
SCHEMBL210050 0.75
SCHEMBL2607890 0.75 LMNA (0.46) KDM4ELMNAPOLBKDM5CPHF8
SCHEMBL13129296 0.75 LMNA (0.46) KDM4ELMNAPOLBKDM5CPHF8
SCHEMBL8163507 0.74 KDM4E (0.59) KDM4ELMNAPOLBKDM5CPHF8
Hydrochloric Acid SCHEMBL4036944 0.74
SCHEMBL20374795 0.74 PHF8 (0.68) KDM4ELMNAPOLBKDM5CPHF8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1307449-B1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMA (JP) 2005-12-07 EP disclosed
US-6653313-B2 For treatment and prevention of inflammation, asthma, allergic rhinitis, pain and other disorders WARNER-LAMBERT COMPANY LLC 2003-11-25 US disclosed
EP-1307449-A1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2003-05-07 EP disclosed
WO-2002012235-A1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMACEUTICALS INC. (JP) 2002-02-14 WO disclosed