SCHEMBL11245261

SCHEMBL11245261

CCCCCCCCOCC(C)Nc1ncnc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.56
▸ LMNA P02545 2/20 0.56
▸ S1PR2 O95136 1/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ GALR3 O60755 1/20 0.49
▸ NR2F2 P24468 1/20 0.49
▸ LDHA P00338 1/20 0.45
▸ HTT P42858 3/20 0.44
▸ GAA P10253 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ EGFR P00533 3/20 0.42
▸ DAPK3 O43293 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42

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
SCHEMBL11246634 0.84 SMN1; SMN2 (0.51) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL11254153 0.82 LDHA (0.61) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL11254918 0.81 SMN1; SMN2 (0.56) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL11251521 0.79 SMN1; SMN2 (0.85) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL11249943 0.79 SMN1; SMN2 (0.80) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL11247766 0.79 SMN1; SMN2 (0.85) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL15923281 0.79 SMN1; SMN2 (0.85) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL4572178 0.78 GALR3 (0.63) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL13283199 0.78 GALR3 (0.63) SMN1; SMN2LMNAS1PR2NPSR1GALR3
SCHEMBL11256846 0.77 NR2F2 (0.59) SMN1; SMN2LMNAGALR3NR2F2LDHA

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-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 — — US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 — — US disclosed
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