SCHEMBL6090108

SCHEMBL6090108

CCCCCc1cc(Cl)ncc1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.39
TSHR P16473 3/20 0.39
HSD17B10 Q99714 2/20 0.39
MEN1 O00255 2/20 0.39
HTT P42858 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
AR P10275 2/20 0.37
SRC P12931 2/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
CSNK1A1 P48729 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
NPC1 O15118 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL24135362 0.89 PGK1 (0.37) L3MBTL1TSHRHSD17B10MEN1HTT
SCHEMBL23586637 0.82 MAPK1 (0.38) L3MBTL1MEN1KMT2AKDM4EAR
SCHEMBL953239 0.81 GABRP (0.49) L3MBTL1TSHRHSD17B10MEN1HTT
SCHEMBL7213412 0.78 AR (0.42) L3MBTL1TSHRHSD17B10MEN1HTT
SCHEMBL18725473 0.75 CSNK1A1 (0.38) HTTGAAARALDH1A1CSNK1A1
SCHEMBL28959310 0.73 NOS2 (0.50) TSHRHSD17B10ALDH1A1HPGD
SCHEMBL6512018 0.72 TSHR (0.39) TSHRHSD17B10MEN1HTTKMT2A
SCHEMBL8450876 0.72 TSHR (0.44) TSHRHSD17B10MEN1HTTKMT2A
SCHEMBL16416384 0.72 TSHR (0.44) TSHRHSD17B10MEN1HTTKMT2A
SCHEMBL2609819 0.72 TSHR (0.44) TSHRHSD17B10MEN1HTTKMT2A

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-7074789-B2 Kinase inhibitors AMGEN INC. (US) 2006-07-11 US disclosed
US-20040116388-A1 triazine compoound inhibitors of enzymes that catalyze phosphoryl transfer and/or that bind ATP/GTP nucleotides AMGEN INC. 2004-06-17 US disclosed