SCHEMBL8465992

SCHEMBL8465992

CCCCCCCCNc1n[c]nc(NCCCCCCCC)n1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
KCNH3 Q9ULD8 2/20 0.49
DNM2 P50570 9/20 0.45
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SLC29A1 Q99808 1/20 0.39
EPHX1 P07099 1/20 0.38
MMP3 P08254 1/20 0.38
GPR84 Q9NQS5 1/20 0.37

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
SCHEMBL6279465 0.98 KCNH3 (0.50) KMT2AKCNH3DNM2MAPTHTT
SCHEMBL9118084 0.92 SLC29A1 (0.44) KMT2AKCNH3DNM2NPSR1SLC29A1
SCHEMBL5691712 0.85 KMT2A (0.55) KMT2AKCNH3DNM2NPSR1SLC29A1
SCHEMBL11173786 0.85 DNM2 (0.41) KMT2AKCNH3DNM2SLC29A1MMP3
SCHEMBL11312208 0.85 KCNH3 (0.44) KMT2AKCNH3DNM2MAPTHTT
SCHEMBL3299537 0.85 KMT2A (0.67) KMT2AKCNH3DNM2MAPTHTT
SCHEMBL14441528 0.85 KMT2A (0.67) KMT2AKCNH3DNM2MAPTHTT
SCHEMBL3298621 0.85 KMT2A (0.67) KMT2AKCNH3DNM2MAPTHTT
SCHEMBL14441519 0.85 KMT2A (0.67) KMT2AKCNH3DNM2MAPTHTT
SCHEMBL8054465 0.85 KMT2A (0.67) KMT2AKCNH3DNM2MAPTHTT

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-5869184-A RESIN RAW MATERIALS FOR PAINTS, ADHESIVES MITSUI TOATSU CHEMICALS, INC. (JP) 1999-02-09 US disclosed
US-5744504-A AMINO RESIN; THERMOSETTING MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1998-04-28 US disclosed