SCHEMBL28931485

SCHEMBL28931485

CCCCC(=O)Nc1nc2c(ccc3ccccc32)s1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.71
▸ KMT2A Q03164 7/20 0.71
▸ POLB P06746 1/20 0.71
▸ ALDH1A1 P00352 4/20 0.61
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ HPGD P15428 1/20 0.61
▸ XIAP P98170 1/20 0.60
▸ MAPT P10636 8/20 0.58
▸ LMNA P02545 2/20 0.58
▸ NPC1 O15118 4/20 0.57
▸ RAB9A P51151 3/20 0.55
▸ HTT P42858 2/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ BCHE P06276 3/20 0.51
▸ GRIN2B Q13224 2/20 0.51
▸ ACHE P22303 1/20 0.48

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
SCHEMBL28931495 0.95 MEN1 (0.69) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL28962431 0.94 MEN1 (0.76) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL28962447 0.80 MEN1 (0.71) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL28931499 0.78 BCHE (0.50) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL6227275 0.78 MAPT (0.73) POLBALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL28937884 0.77 SMN1; SMN2 (0.61) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL19497770 0.76 MEN1 (0.50) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL28931500 0.76 NPC1 (0.54) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL4961093 0.76 KMT2A (0.67) MEN1KMT2APOLBALDH1A1SMN1; SMN2
SCHEMBL10695859 0.74 MAPT (0.75) POLBALDH1A1SMN1; SMN2MAPTNPC1

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
CN-115417833-B Synthesis method of 2-amido naphtho [1,2-d ] thiazole 池州学院 2024-05-28 — — CN disclosed
CN-115417833-A Synthesis method of 2-acylamino naphtho [1,2-d ] thiazole 池州学院 2022-12-02 — — CN disclosed
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