SCHEMBL11245960

SCHEMBL11245960

Cc1ccccc1OCC(C)Nc1ncnc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR2F2 P24468 3/20 0.52
▸ GALR3 O60755 2/20 0.52
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ PKM P14618 1/20 0.45
▸ LDHA P00338 1/20 0.45
▸ RAB9A P51151 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ POLB P06746 2/20 0.43
▸ ADRB2 P07550 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ ADRB3 P13945 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ EGFR P00533 5/20 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
SCHEMBL11245912 0.87 ABCG2 (0.53) NR2F2GALR3SMN1; SMN2MAPK1GAA
SCHEMBL11256846 0.83 NR2F2 (0.59) NR2F2GALR3SMN1; SMN2MAPK1HTT
SCHEMBL11254153 0.82 LDHA (0.61) NR2F2GALR3SMN1; SMN2MAPK1GAA
SCHEMBL11250025 0.82 NPC1 (0.52) NR2F2GALR3SMN1; SMN2MAPK1HTT
SCHEMBL11104898 0.80 ADRB2 (0.42) SMN1; SMN2ALOX15HTTRAB9ANPC1
SCHEMBL11240075 0.79 EGFR (0.53) NR2F2GALR3SMN1; SMN2MAPK1HTT
SCHEMBL11255628 0.79 GBA1 (0.56) NR2F2GALR3SMN1; SMN2MAPK1HTT
SCHEMBL11248882 0.79 EGFR (0.52) NR2F2GALR3SMN1; SMN2HTTLDHA
SCHEMBL13283199 0.78 GALR3 (0.63) NR2F2GALR3SMN1; SMN2MAPK1GAA
SCHEMBL4572178 0.78 GALR3 (0.63) NR2F2GALR3SMN1; SMN2MAPK1GAA

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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