SCHEMBL6174571

SCHEMBL6174571

NC(=O)c1ccccc1-c1ncccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
CSNK1A1 P48729 1/20 0.49
TYRO3 Q06418 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
BCAT2 O15382 1/20 0.47
PARP1 P09874 2/20 0.46
ALOX5AP P20292 1/20 0.45
FEN1 P39748 1/20 0.45
GRM5 P41594 2/20 0.45
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NUDT1 P36639 1/20 0.43
CDC7 O00311 1/20 0.43
NTRK1 P04629 1/20 0.43
LMNA P02545 1/20 0.43
NAPRT Q6XQN6 1/20 0.42
MKNK1 Q9BUB5 1/20 0.42

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
SCHEMBL4782635 0.87 MAPT (0.55) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL3820615 0.82 KDM4E (0.65) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL6174931 0.80 PARP1 (0.48) MAPTHTTCSNK1A1TYRO3DYRK1B
SCHEMBL6176200 0.77 CDC7 (0.47) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL2113823 0.77 NPC1 (0.59) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL4186883 0.77 KDM4E (0.65) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL28225057 0.76 MAPT (0.47) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL30108309 0.76 MAPT (0.47) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL5797893 0.76 CDC7 (0.48) MAPTHTTNPC1RAB9ACSNK1A1
SCHEMBL27741632 0.76 DGAT1 (0.47) MAPTHTTNPC1RAB9ACSNK1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575918-A2 SUBSTITUTED BIARYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2005-09-21 EP claimed
WO-2004056774-A2 SUBSTITUTED BIPHENYL-4-CARBOXYLIC ACID ARYLAMIDE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2004-07-08 WO claimed
CN-102030771-A Compound used as transient receptor potential vanilloid (TRPV1) blocker, medicinal composition and pharmaceutical application thereof QUN SUN 2011-04-27 CN disclosed