SCHEMBL9684955

SCHEMBL9684955

OCCCCCn1nc2ccccc2n1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MPO P05164 2/20 0.50
CSNK2A2 P19784 2/20 0.48
CSNK2B P67870 2/20 0.48
CSNK2A1 P68400 2/20 0.48
CSNK2A3 Q8NEV1 2/20 0.48
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.39
PDE5A O76074 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
CXCR4 P61073 1/20 0.38
CNR2 P34972 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL6699751 0.92 CSNK2A2 (0.48) MPOCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL6954586 0.83 ATM (0.43) MPOMEN1KMT2AMAPT
SCHEMBL8118256 0.81 PTGIR (0.48) MPOCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL366356 0.80 MAPT (0.46) MAPTTDP1CXCR4
SCHEMBL17223973 0.80 CXCR4 (0.38) MPOMAPTCXCR4
SCHEMBL17528648 0.80 TLR8 (0.54) MPOMEN1KMT2AMAPTTDP1
SCHEMBL14799694 0.80 TLR8 (0.54) MPOMEN1KMT2AMAPTTDP1
SCHEMBL19138003 0.80 SLC9A1 (0.43) MAPTTDP1CXCR4SMN1; SMN2
SCHEMBL11325500 0.80 TLR8 (0.54) MPOMEN1KMT2AMAPTTDP1
SCHEMBL892083 0.80 TLR8 (0.54) MPOMEN1KMT2AMAPTTDP1

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-5097041-A PURIFICATION OF 2-ARYL-2H-BENZOTRIAZOLES CIBA-GEIGY CORPORATION (US) 1992-03-17 US disclosed
EP-0424316-A2 Purification of 2-aryl-2h-benzotriazoles CIBA-GEIGY AG (CH) 1991-04-24 EP disclosed