SCHEMBL7448538

SCHEMBL7448538

Cc1n[nH]c(C(N)=O)c1CCN

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR6 P50406 1/20 0.33
PDE4D Q08499 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
PDPK1 O15530 1/20 0.32
TTR P02766 2/20 0.32
ALB P02768 1/20 0.32
AR P10275 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30
CCNA1 P78396 1/20 0.30
P2RX7 Q99572 2/20 0.30
UMPS P11172 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
Oxalic Acid SCHEMBL7507025 0.75 KDM4E (0.47) LMNAMEN1KMT2APDE4DKDM4E
SCHEMBL15318187 0.73 MAPK1 (0.36) LMNAMEN1KMT2AHTR6KDM4E
SCHEMBL5337870 0.72 MAPK1 (0.57) LMNAMEN1KMT2AKDM4EMAPK1
SCHEMBL8597031 0.72 DYRK1A (0.42) LMNAPDE4DPDPK1L3MBTL1CCNA2
SCHEMBL6336859 0.71 PDPK1 (0.41) LMNAPDE4DPDPK1L3MBTL1CCNA2
SCHEMBL15871865 0.71 UMPS (0.40) LMNAPDE4DPDPK1L3MBTL1CCNA2
Hydrochloric Acid SCHEMBL1999396 0.71 KDM4E (0.60) LMNAMEN1KMT2AKDM4EMAPK1
SCHEMBL459936 0.71 KDM4E (0.37) LMNAMEN1KMT2AKDM4EMAPK1
Hydrochloric Acid SCHEMBL6559450 0.69 KDM4E (0.40) LMNAMEN1KMT2AKDM4EMAPK1
SCHEMBL3997044 0.69 DPP4 (0.36) PDPK1ALDH1A1

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-1993006104-A1 PYRAZOLOPYRIMIDINONE ANTIANGINAL AGENTS PFIZER LIMITED (GB) 1993-04-01 WO disclosed