SCHEMBL2860829

SCHEMBL2860829

NC(=O)c1cccc(NC(=O)Oc2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.42
PARP1 P09874 1/20 0.42
PARP14 Q460N5 1/20 0.42
ACHE P22303 1/20 0.41
MAPT P10636 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RHOC P08134 1/20 0.40
RHOA P61586 1/20 0.40
NPSR1 Q6W5P4 2/20 0.38
ATM Q13315 2/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HSP90AA1 P07900 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BRAF P15056 1/20 0.38
CCR1 P32246 3/20 0.38
ORAI1 Q96D31 1/20 0.37

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
SCHEMBL2856756 0.93 ACHE (0.40) ACHEMAPTMEN1KMT2ARHOC
SCHEMBL2860939 0.91 LMNA (0.45) MAPTMEN1KMT2ARHOCRHOA
SCHEMBL2853385 0.90 MAPT (0.42) ACHEMAPTMEN1KMT2ANPSR1
SCHEMBL2850258 0.89 MAPT (0.51) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2852360 0.89 MAPT (0.42) ACHEMAPTMEN1KMT2ANPSR1
SCHEMBL2854221 0.87 MAPT (0.51) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2854572 0.87 RAB9A (0.44) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2852565 0.87 MAPT (0.42) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2853258 0.87 NPY5R (0.45) MAPTMEN1KMT2ANPSR1KDM4E
SCHEMBL2848615 0.87 MAPT (0.44) MAPTMEN1KMT2ANPSR1ATM

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-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed