SCHEMBL10179938

SCHEMBL10179938

CONC(=N)NCc1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 2/20 0.50
ATG4B Q9Y4P1 2/20 0.50
TSHR P16473 1/20 0.47
LMNA P02545 4/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 3/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
ATM Q13315 1/20 0.46
HPGD P15428 3/20 0.45
MEN1 O00255 2/20 0.44
TP53 P04637 1/20 0.44

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
Hydrochloric Acid SCHEMBL3112636 0.98 PLA2G1B (0.49) PLA2G1BATG4BTSHRLMNAKMT2A
SCHEMBL10590731 0.80 PLA2G1B (0.55) PLA2G1BATG4BLMNAKMT2AMAOB
SCHEMBL17777347 0.77 PLA2G1B (0.52) PLA2G1BATG4BTSHRLMNAKMT2A
SCHEMBL5447702 0.76 HPGD (0.47) PLA2G1BATG4BTSHRLMNAKMT2A
Hydrochloric Acid SCHEMBL19371473 0.76 PLA2G1B (0.50) PLA2G1BATG4BTSHRLMNAKMT2A
SCHEMBL4015337 0.76 PLA2G1B (0.59) PLA2G1BATG4BTSHRLMNAKMT2A
SCHEMBL16216177 0.76 PLA2G1B (0.59) PLA2G1BATG4BLMNAKMT2AMAOB
SCHEMBL13158620 0.76 PLA2G1B (0.59) PLA2G1BATG4BTSHRLMNAKMT2A
Hydrochloric Acid SCHEMBL27636314 0.74 PLA2G1B (0.57) PLA2G1BATG4BTSHRLMNAKMT2A
SCHEMBL19321442 0.73 TSHR (0.59) PLA2G1BATG4BTSHRLMNAKMT2A

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
EP-2474525-A2 Ligands for imaging cardiac innervation Lantheus Medical Imaging, Inc. (US) 2012-07-11 EP disclosed