SCHEMBL31314979

SCHEMBL31314979

c1nc2ccc(/N=N/c3ccc4ncsc4c3)cc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
POLB P06746 2/20 0.58
HPGD P15428 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
MAPT P10636 2/20 0.55
KMT2A Q03164 4/20 0.52
TDP1 Q9NUW8 2/20 0.52
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
KDM4E B2RXH2 1/20 0.50
HKDC1 Q2TB90 1/20 0.50
HSD17B10 Q99714 1/20 0.48
DYRK1A Q13627 4/20 0.47
GFER P55789 1/20 0.40
MEN1 O00255 3/20 0.39
APP P05067 1/20 0.39
RIPK1 Q13546 1/20 0.39
DYRK2 Q92630 3/20 0.38
DYRK1B Q9Y463 3/20 0.38

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
SCHEMBL11976454 0.86 NPC1 (0.53) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
Dimethylamine SCHEMBL28233588 0.85 L3MBTL1 (0.52) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL29436238 0.85 MAPT (0.48) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL9223659 0.85 L3MBTL1 (0.50) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL9228846 0.83 ALDH1A1 (0.46) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL14404746 0.80 NPC1 (0.47) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL22042124 0.80 NPC1 (0.44) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL30954747 0.78 ALDH1A1 (0.45) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL29265409 0.78 ALDH1A1 (0.45) ALDH1A1L3MBTL1POLBHPGDSMN1; SMN2
SCHEMBL23480172 0.77 NPC1 (0.52) ALDH1A1L3MBTL1POLBHPGDSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955769-B Gold-based catalyst for polyvinyl chloride production and preparation method and application thereof 南开大学 2025-01-10 CN claimed
CN-118955769-A Gold-based catalyst for polyvinyl chloride production and preparation method and application thereof 南开大学 2024-11-15 CN claimed
CN-118955769-B Gold-based catalyst for polyvinyl chloride production and preparation method and application thereof 南开大学 2025-01-10 CN disclosed
CN-118955769-A Gold-based catalyst for polyvinyl chloride production and preparation method and application thereof 南开大学 2024-11-15 CN disclosed