SCHEMBL11285261

SCHEMBL11285261

CCCCc1ccc(OCCNc2ncnc(CCC)c2Cl)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.37
S1PR2 O95136 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 4/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 2/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
STAT3 P40763 1/20 0.36
KMT2A Q03164 1/20 0.36
SKP2 Q13309 1/20 0.35
GALR3 O60755 3/20 0.35
NPC1 O15118 2/20 0.35
NR2F2 P24468 2/20 0.35
RAB9A P51151 2/20 0.35
APP P05067 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
SCHEMBL11281476 0.97 S1PR2 (0.39) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11280715 0.95 MAPT (0.38) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11103934 0.89 SMN1; SMN2 (0.39) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11287251 0.88 SMN1; SMN2 (0.38) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11110896 0.87 SMN1; SMN2 (0.39) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11289412 0.87 SMN1; SMN2 (0.40) SMN1; SMN2MAPTKDM4EMAPK1KMT2A
SCHEMBL11107563 0.86 S1PR2 (0.40) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11283599 0.85 S1PR2 (0.41) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
SCHEMBL11110973 0.85 S1PR2 (0.41) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2
Hydrochloric Acid SCHEMBL11103276 0.85 SMN1; SMN2 (0.40) SMN1; SMN2S1PR2S1PR1S1PR3LPAR2

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
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