SCHEMBL4068967

SCHEMBL4068967

CSc1cc(Cl)ccc1-c1ccc(NC(=O)c2c(C)cccc2C)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 4/20 0.43
KCNQ2 O43526 4/20 0.43
KCNE1 P15382 3/20 0.43
KCNQ1 P51787 3/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TYK2 P29597 1/20 0.41
CYP11B2 P19099 1/20 0.41
ABL1 P00519 1/20 0.40
SRC P12931 1/20 0.40
AHR P35869 1/20 0.40
DHODH Q02127 1/20 0.40
KCNQ5 Q9NR82 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
RAB9A P51151 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
CSF1R P07333 1/20 0.38
F2R P25116 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL4070576 0.90 DHODH (0.45) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL4068770 0.88 NPC1 (0.50) MEN1KMT2ACYP11B2AHRDHODH
SCHEMBL4063151 0.79 P4HTM (0.43) MEN1KMT2ATYK2ABL1SRC
SCHEMBL4247327 0.77 BRAF (0.45) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL4061473 0.74 DHODH (0.49) TYK2ABL1SRCDHODHRAB9A
SCHEMBL4064010 0.73 TYK2 (0.45) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL4058614 0.72 GRM8 (0.53) LMNAPOLB
SCHEMBL4068973 0.72 TYK2 (0.46) KCNQ3KCNQ2KCNE1KCNQ1KMT2A
SCHEMBL5934780 0.70 P4HTM (0.53) KCNQ3KCNQ2KCNE1KCNQ1MEN1
SCHEMBL4062046 0.70 MAPT (0.54) KCNQ3KCNQ2KCNE1KCNQ1MEN1

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
EP-1028945-B9 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2009-02-18 EP disclosed
EP-1028945-B1 SUBSTITUTED PYRIDINE COMPOUNDS AS ANTI-INFLAMMATORY AGENTS AMGEN INC (US) 2007-07-11 EP disclosed