SCHEMBL28685759

SCHEMBL28685759

Brc1ccccc1C1=NC(Cc2ccccc2)CO1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.66
NPC1 O15118 1/20 0.66
POLB P06746 1/20 0.66
RAB9A P51151 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
TAAR1 Q96RJ0 5/20 0.55
ALDH1A1 P00352 1/20 0.49
HRH3 Q9Y5N1 1/20 0.46
MAOB P27338 1/20 0.38
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37

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
SCHEMBL27866967 1.00 MAPT (0.66) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL28694392 1.00 MAPT (0.66) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL12786229 0.84 MAPT (0.71) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL1983682 0.84 MAPT (0.71) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL27868037 0.84 MAPT (0.59) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL14448351 0.84 MAPT (0.59) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL4577849 0.82 NPC1 (0.43) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL4577847 0.82 NPC1 (0.43) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL27259774 0.80 MAPT (0.80) MAPTNPC1POLBRAB9ASMN1; SMN2
SCHEMBL27866966 0.78 NOS2 (0.41) MAPTNPC1POLBRAB9ASMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119707848-A Water-containing salicylaldehyde diamine oxazoline compound and metal complex thereof, and preparation method and application thereof 浙江大学 2025-03-28 CN disclosed
CN-114085250-B Preparation and application of P-chiral phosphine-oxazoline ligand metal complex catalyst containing Ugi's amine building block 中国人民解放军空军军医大学 2024-01-19 CN disclosed
CN-114085250-A Preparation and application of P-chiral phosphine-oxazoline ligand metal complex catalyst containing Ugi's amine building blocks 中国人民解放军空军军医大学 2022-02-25 CN disclosed