SCHEMBL28695201

SCHEMBL28695201

Brc1ccccc1C1=NC(c2ccccc2)CO1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
TAAR1 Q96RJ0 4/20 0.51
ALDH1A1 P00352 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 1/20 0.50
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
INPP5D Q92835 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL28695196 1.00 MAPT (0.54) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL7689039 0.88 MAPT (0.61) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL29708126 0.88 MAPT (0.61) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL19367694 0.82 MAPT (0.67) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL28665807 0.82 TAAR1 (0.62) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL25746558 0.82 MAPT (0.55) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL25746548 0.82 MAPT (0.55) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL28682353 0.82 TAAR1 (0.62) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL28665805 0.82 TAAR1 (0.62) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL22745044 0.79 MAPT (0.52) MAPTTAAR1ALDH1A1SMN1; SMN2NPC1

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