SCHEMBL5749103

SCHEMBL5749103

CCCCCc1ccc(Cl)nc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.41
TYR P14679 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALOX5 P09917 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
CTRC Q99895 1/20 0.40
TLR8 Q9NR97 3/20 0.39
LIPG Q9Y5X9 1/20 0.38
GSR P00390 1/20 0.36
TXNRD1 Q16881 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
PTGS2 P35354 1/20 0.34
ELANE P08246 1/20 0.34

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
SCHEMBL5749380 0.98 KCNH2 (0.44) KCNH2TYRTDP1ALOX5MEN1
SCHEMBL5748047 0.98 KCNH2 (0.44) KCNH2TYRTDP1ALOX5MEN1
SCHEMBL5746988 0.98 KCNH2 (0.44) KCNH2TYRTDP1ALOX5MEN1
SCHEMBL5746427 0.94 CTRC (0.44) KCNH2TYRTDP1ALOX5MEN1
SCHEMBL5748559 0.86 ALDH1A1 (0.35) HTTKMT2ACTRC
SCHEMBL15951097 0.81 SIRT2 (0.35) TLR8
SCHEMBL10763935 0.79 TLR8 (0.39) KCNH2TYRTDP1ALOX5MEN1
SCHEMBL20467095 0.79 ALOX5 (0.41) KCNH2TYRTDP1ALOX5MEN1
SCHEMBL15951054 0.78 SIRT2 (0.39) TLR8
SCHEMBL5746997 0.78 GPR84 (0.33)

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-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed