SCHEMBL11110174

SCHEMBL11110174

CCCc1ccc(OCCNc2ncnc(Cl)c2C)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GALR3 O60755 3/20 0.41
MAPT P10636 5/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 2/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 6/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 2/20 0.38
STAT3 P40763 1/20 0.38
APP P05067 1/20 0.37
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
NR2F2 P24468 3/20 0.37
HTT P42858 5/20 0.36
TSHR P16473 4/20 0.36
LMNA P02545 2/20 0.36
HSD17B10 Q99714 1/20 0.36
GAA P10253 2/20 0.35
S1PR2 O95136 1/20 0.35

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
SCHEMBL11034640 0.92 S1PR2 (0.40) GALR3MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11110500 0.91 S1PR2 (0.41) GALR3MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11111531 0.91 S1PR2 (0.41) GALR3MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11107134 0.91 S1PR2 (0.41) GALR3MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11103205 0.91 GALR3 (0.40) GALR3MAPTPOLBKDM4ERECQL
SCHEMBL11108080 0.90 GALR3 (0.40) GALR3MAPTPOLBKDM4ERECQL
SCHEMBL11107454 0.88 SMN1; SMN2 (0.40) GALR3MAPTPOLBKDM4ERECQL
SCHEMBL11111354 0.88 GALR3 (0.39) GALR3MAPTPOLBKDM4ERECQL
SCHEMBL11108006 0.86 MAPT (0.39) GALR3MAPTPOLBKDM4ERECQL
SCHEMBL11280715 0.85 MAPT (0.38) GALR3MAPTPOLBKDM4ERECQL

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-4435402-A Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY, LIMITED (JP) 1984-03-06 US disclosed
EP-0057440-A1 Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1982-08-11 EP disclosed