SCHEMBL7317023

SCHEMBL7317023

COc1ccc(-c2ccc(C=O)o2)cc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
KDM4E B2RXH2 6/20 0.48
LMNA P02545 2/20 0.48
PDE4A P27815 1/20 0.46
LDHA P00338 1/20 0.43
LDHB P07195 1/20 0.43
HAO1 Q9UJM8 1/20 0.43
POLB P06746 3/20 0.42
TDP1 Q9NUW8 2/20 0.41
MAPT P10636 3/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HSP90AA1 P07900 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 2/20 0.41
TP53 P04637 1/20 0.41
S1PR1 P21453 1/20 0.40
STAT1 P42224 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL7330422 0.83 KDM4E (0.52) ALDH1A1KDM4EPDE4AMAPTSMN1; SMN2
SCHEMBL7330415 0.83 KDM4E (0.52) ALDH1A1KDM4EPDE4AMAPTSMN1; SMN2
SCHEMBL14300697 0.83 ALDH1A1 (0.59) ALDH1A1KDM4ELMNAPDE4AMAPT
SCHEMBL14300696 0.83 ALDH1A1 (0.59) ALDH1A1KDM4ELMNAPDE4AMAPT
SCHEMBL6385751 0.83 PDE4A (0.69) ALDH1A1KDM4ELMNAPDE4ALDHA
SCHEMBL1409530 0.79 PSEN1 (0.42) ALDH1A1KDM4EPDE4AMAPTTP53
SCHEMBL30861661 0.79 KDM4E (0.52) ALDH1A1KDM4ELMNALDHALDHB
SCHEMBL1806721 0.79 KDM4E (0.52) ALDH1A1KDM4ELMNALDHALDHB
SCHEMBL1116276 0.79 HTRA2 (0.56) ALDH1A1KDM4ELMNAPDE4ALDHA
SCHEMBL1409527 0.78 FDPS (0.44) ALDH1A1KDM4ELMNAPOLBMAPT

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