SCHEMBL7319956

SCHEMBL7319956

COc1ccc(-c2ccc(C#N)o2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.50
CACNA1G O43497 1/20 0.49
CACNA1B Q00975 1/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 3/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
HTRA2 O43464 1/20 0.42
PGR P06401 2/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FTO Q9C0B1 1/20 0.42
GRM2 Q14416 1/20 0.41
PTGS2 P35354 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAOB P27338 1/20 0.39

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
SCHEMBL11709937 0.86 PDE4A (0.69) PDE4AMEN1KMT2AMAPTKDM4E
SCHEMBL7326155 0.79 PDE4A (0.50) PDE4AMAPTKDM4EPGRHTT
SCHEMBL7320359 0.79 CTSS (0.47) PDE4AKDM4EPGR
SCHEMBL14112775 0.75 PDE4A (0.51) PDE4ACACNA1GCACNA1BMEN1KMT2A
SCHEMBL11777406 0.74 NQO2 (0.49) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL1116276 0.73 HTRA2 (0.56) PDE4ACACNA1GCACNA1BMEN1KMT2A
SCHEMBL12326172 0.73 PTGS2 (0.53) MEN1KMT2AGAAPTGS2ALDH1A1
SCHEMBL395933 0.73 PGR (0.46) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL10555140 0.72 ALDH1A1 (0.44) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL10465079 0.71 PGR (0.42) KDM4ELMNATP53PGRSMN1; SMN2

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
US-4882354-A N-hydroxy-5-phenyl-2-furancarboximidamides useful as cardiotonic agents NORWICH EATON PHARMACEUTICALS, INC. (US) 1989-11-21 US disclosed
EP-0321431-A1 N-hydroxy-5-phenyl-2-furancarboximidamides useful as cardiotonic agents Norwich Eaton Pharmaceuticals, Inc. (US) 1989-06-21 EP disclosed