SCHEMBL11111880

SCHEMBL11111880

Cc1ccc(OCCNc2ncnc(Cl)c2C)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
GALR3 O60755 1/20 0.42
L3MBTL1 Q9Y468 5/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
S1PR4 O95977 1/20 0.41
MAPT P10636 4/20 0.40
HPGD P15428 4/20 0.40
HTR1A P08908 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
HIF1A Q16665 1/20 0.39
MAPK1 P28482 2/20 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
SCHEMBL11107144 0.90 L3MBTL1 (0.45) SMN1; SMN2LMNAHTTGALR3L3MBTL1
SCHEMBL11286500 0.90 KDM4E (0.45) SMN1; SMN2LMNAHTTKMT2ANPC1
SCHEMBL11101656 0.88 SMN1; SMN2 (0.42) SMN1; SMN2LMNAHTTGALR3L3MBTL1
SCHEMBL11288219 0.88 SMN1; SMN2 (0.42) SMN1; SMN2LMNAHTTGALR3L3MBTL1
SCHEMBL11105567 0.88 L3MBTL1 (0.52) SMN1; SMN2LMNAHTTGALR3L3MBTL1
SCHEMBL11103158 0.87 SMN1; SMN2 (0.45) SMN1; SMN2LMNAHTTL3MBTL1KMT2A
SCHEMBL11103205 0.86 GALR3 (0.40) SMN1; SMN2LMNAHTTGALR3KMT2A
SCHEMBL11105240 0.86 LMNA (0.41) SMN1; SMN2LMNAHTTGALR3L3MBTL1
SCHEMBL11290090 0.85 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTGALR3L3MBTL1
SCHEMBL11109296 0.85 SMN1; SMN2 (0.43) SMN1; SMN2LMNAHTTL3MBTL1KMT2A

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