SCHEMBL4008657

SCHEMBL4008657

CN=C(N(C)C)N(C)c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.46
CHKA P35790 1/20 0.46
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PLG P00747 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
RAB9A P51151 1/20 0.33
HBB P68871 1/20 0.33
MLYCD O95822 1/20 0.33
POLQ O75417 1/20 0.33
SLC6A2 P23975 1/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GFER P55789 1/20 0.30
POLB P06746 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
SCHEMBL4008655 1.00 CHRM5 (0.46) CHRM5CHKAKMT2AKDM4EMAPT
SCHEMBL725900 0.79 FAAH (0.45) KMT2AKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL725899 0.79 FAAH (0.45) KMT2AKDM4EMAPTSMN1; SMN2MEN1
SCHEMBL48868 0.72 PLG (0.52) CHRM5CHKAKMT2AKDM4EMAPT
SCHEMBL25137294 0.70 FAAH (0.48) KMT2AKDM4ESMN1; SMN2MEN1NPC1
SCHEMBL14344787 0.68 CHRM5 (0.52) CHRM5CHKAKMT2AKDM4EMAPT
SCHEMBL4385687 0.68 KMT2A (0.53) CHRM5CHKAKMT2AKDM4EMAPT
SCHEMBL481904 0.68 KDM4E (0.58) CHRM5CHKAKMT2AKDM4EMAPT
SCHEMBL29587923 0.67
SCHEMBL429504 0.67 KDM4E (0.52) CHRM5CHKAKMT2AKDM4EMAPT

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
WO-2009074678-A2 ANTICANCER CONJUGATES OF CAMPTOTHECIN TO HYALURONIC ACID EURAND PHARMACEUTICALS LIMITED (IE) 2009-06-18 WO claimed
WO-2009074678-A2 ANTICANCER CONJUGATES OF CAMPTOTHECIN TO HYALURONIC ACID EURAND PHARMACEUTICALS LIMITED (IE) 2009-06-18 WO disclosed