SCHEMBL7774646

SCHEMBL7774646

CCCCCCCCCCCCNc1nc(NCCCC)nc(N(CCCC)CCCC)n1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 3/20 0.50
KMT2A Q03164 1/20 0.50
DNM2 P50570 9/20 0.47
KCNH3 Q9ULD8 2/20 0.46
CRHR1 P34998 1/20 0.43
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL7776204 1.00 SLC29A1 (0.50) SLC29A1KMT2ADNM2KCNH3CRHR1
SCHEMBL6641031 0.95 SLC29A1 (0.51) SLC29A1KMT2ADNM2KCNH3CRHR1
SCHEMBL6716597 0.93 SLC29A1 (0.50) SLC29A1KMT2ADNM2KCNH3CRHR1
SCHEMBL6720244 0.91 SLC29A1 (0.51) SLC29A1KMT2ADNM2KCNH3CRHR1
SCHEMBL21427481 0.85 SLC29A1 (0.47) SLC29A1KMT2ADNM2KCNH3CRHR1
SCHEMBL11798265 0.85 SLC29A1 (0.43) SLC29A1KMT2ADNM2KCNH3CRHR1
SCHEMBL25434244 0.84 SLC29A1 (0.49) SLC29A1KMT2ADNM2KCNH3MAPT
SCHEMBL11293174 0.84 SLC29A1 (0.49) SLC29A1KMT2ADNM2KCNH3MAPT
SCHEMBL20740718 0.84 KMT2A (0.60) SLC29A1KMT2ADNM2KCNH3MAPT
SCHEMBL17817154 0.84 SLC29A1 (0.67) SLC29A1KMT2ADNM2KCNH3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882720-B1 METHODS FOR MODIFYING 1,3,5-TRIAZINE DERIVATIVES NISSAN CHEMICAL IND LTD (JP) 2001-08-22 EP disclosed
US-6127538-A HYDROXYALKYLATION OF A TRIAMINO TRIAZINE DERIVATIVE HAVING AT LEAST ONE REACTIVE NITROGEN BY REACTING WHILE HEATING WITH AN ALKANEDIOL OR ITS ADDUCT IN THE PRESENCE OF HYDROGEN AND A METAL CATALYST; BY-PRODUCT INHIBITION NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2000-10-03 US disclosed
EP-0882720-A1 METHODS FOR MODIFYING 1,3,5-TRIAZINE DERIVATIVES NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) 1998-12-09 EP disclosed