SCHEMBL9465254

SCHEMBL9465254

Clc1cncc(C2=N[N]C=C2)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
FGFR1 P11362 1/20 0.40
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
HCAR2 Q8TDS4 1/20 0.33
PTGS2 P35354 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA7 P36544 2/20 0.32
CHRNA4 P43681 2/20 0.32
AOC3 Q16853 1/20 0.31
IDH1 O75874 1/20 0.31
MAP4K4 O95819 1/20 0.31
CTSD P07339 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL21744554 0.73 MKNK1 (0.55) MKNK1MKNK2FGFR1CYP11B1CYP11B2
SCHEMBL3516703 0.73 CYP1A2 (0.39)
SCHEMBL28038113 0.68 AHR (0.52)
SCHEMBL1435763 0.67 MKNK1 (0.36) MKNK1MKNK2FGFR1CYP11B1CYP11B2
SCHEMBL1435891 0.67 CYP2A6 (0.54) MKNK1MKNK2CYP11B1CYP11B2
SCHEMBL23348876 0.66 IDH1 (0.50) MKNK1MKNK2FGFR1CYP11B1CYP11B2
SCHEMBL21044253 0.64 MKNK1 (0.51) MKNK1MKNK2FGFR1CYP11B1CYP11B2
SCHEMBL21324351 0.64 MKNK1 (0.56) MKNK1MKNK2FGFR1CYP11B1CYP11B2
SCHEMBL21044096 0.64 MKNK1 (0.61) MKNK1MKNK2FGFR1CYP11B1CYP11B2
SCHEMBL15789495 0.64 MKNK1 (0.56) MKNK1MKNK2FGFR1CYP11B1CYP11B2

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
US-5246914-A Fungicides and plant growth regulators BASF AKTIENGESELLSCHAFT (DE) 1993-09-21 US disclosed