SCHEMBL11110243

SCHEMBL11110243

CSc1ccc(OCCNc2ncnc(Cl)c2C)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.39
▸ PIK3R1 P27986 1/20 0.39
▸ CYP3A4 P08684 4/20 0.38
▸ TSHR P16473 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ DRD2 P14416 2/20 0.34
▸ DRD4 P21917 2/20 0.34
▸ DRD3 P35462 2/20 0.34
▸ GALR3 O60755 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ GAA P10253 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ NPC1 O15118 3/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ CYP2C19 P33261 3/20 0.33
▸ LMNA P02545 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL11254977 0.80 LDHA (0.57) PIK3CDPIK3R1CYP3A4TSHRALDH1A1
SCHEMBL11109561 0.78 DRD2 (0.47) PIK3CDPIK3R1DRD2DRD4DRD3
SCHEMBL11112404 0.74 PIK3CD (0.53) PIK3CDPIK3R1DRD2DRD4DRD3
SCHEMBL11111880 0.73 SMN1; SMN2 (0.43) PIK3CDPIK3R1TSHRALDH1A1GALR3
SCHEMBL11286500 0.73 KDM4E (0.45) PIK3CDPIK3R1CYP3A4ALDH1A1HPGD
SCHEMBL11105916 0.73 S1PR4 (0.47) PIK3CDPIK3R1CYP3A4TSHRALDH1A1
SCHEMBL11102550 0.73 DRD2 (0.45) PIK3CDPIK3R1CYP3A4TSHRALDH1A1
SCHEMBL11290156 0.71 LMNA (0.46) PIK3CDPIK3R1CYP3A4ALDH1A1HSD17B10
SCHEMBL11107144 0.71 L3MBTL1 (0.45) PIK3CDPIK3R1CYP3A4ALDH1A1GALR3
SCHEMBL11103205 0.71 GALR3 (0.40) PIK3CDPIK3R1GALR3NPC1LMNA

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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