SCHEMBL11103109

SCHEMBL11103109

Cc1c(Br)ncnc1NCCOc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.51
▸ PIK3R1 P27986 1/20 0.51
▸ HTR1B P28222 2/20 0.46
▸ HTR1D P28221 1/20 0.46
▸ HTR7 P34969 2/20 0.45
▸ DRD4 P21917 9/20 0.43
▸ DRD2 P14416 8/20 0.43
▸ DRD3 P35462 6/20 0.43
▸ LDHA P00338 1/20 0.43
▸ MTNR1A P48039 1/20 0.41
▸ MTNR1B P49286 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ GBA1 P04062 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
SCHEMBL11102255 0.85 PIK3CD (0.53) PIK3CDPIK3R1HTR1BHTR1DHTR7
SCHEMBL11105081 0.83 DRD2 (0.45) HTR1BDRD4DRD2DRD3LDHA
SCHEMBL11102959 0.83 PIK3CD (0.51) PIK3CDPIK3R1HTR1BHTR1DHTR7
SCHEMBL11105028 0.80 DRD2 (0.47) HTR1BDRD4DRD2DRD3L3MBTL1
SCHEMBL11287541 0.79 PPARD (0.40) LDHAL3MBTL1
SCHEMBL11104385 0.79 LMNA (0.45) LDHAL3MBTL1
SCHEMBL11112404 0.79 PIK3CD (0.53) PIK3CDPIK3R1HTR1BHTR1DHTR7
SCHEMBL11107868 0.78 CYP2C19 (0.43) DRD2LDHA
SCHEMBL11109514 0.77 PIK3CD (0.57) PIK3CDPIK3R1HTR1BHTR1DHTR7
SCHEMBL11109296 0.76 SMN1; SMN2 (0.43) L3MBTL1

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
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