SCHEMBL435524

SCHEMBL435524

CCC(CCCCCCNC(=N)N)NC(=N)N

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
CYP1A2 P05177 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALOX15 P16050 1/20 0.37
ITGB3 P05106 3/20 0.34
ITGA2B P08514 3/20 0.34
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
SIRT6 Q8N6T7 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
SPHK1 Q9NYA1 3/20 0.33
RRM1 P23921 1/20 0.32
EPHX1 P07099 1/20 0.32
DPP7 Q9UHL4 1/20 0.31
CASP2 P42575 1/20 0.31
ALB P02768 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
SCHEMBL28966032 0.84 MEN1 (0.44) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL17046803 0.82 SPHK1 (0.39) CYP1A2SPHK1
SCHEMBL433663 0.80 MEN1 (0.47) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL22132960 0.80 MEN1 (0.47) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL10725785 0.80 MEN1 (0.41) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL20099658 0.79 MEN1 (0.38) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL19199246 0.78 MEN1 (0.44) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL29057242 0.78 MEN1 (0.42) MEN1CYP1A2KMT2ASMN1; SMN2GNAI3
SCHEMBL19889392 0.77 MEN1 (0.43) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15
SCHEMBL16138483 0.77 MEN1 (0.43) MEN1CYP1A2KMT2ASMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012010641-A2 PHARMACEUTICAL COMPOSITION FOR INCREASING CELLULAR HYPOXIC TOLERANCE UNIVERSITE DE NICE SOPHIA ANTIPOLIS (FR) 2012-01-26 WO disclosed