SCHEMBL7992142

SCHEMBL7992142

CNc1ccc(-c2nc(C(=O)Nc3nncs3)c(-c3ccc(OC)cc3)[nH]2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 8/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
GAA P10253 3/20 0.42
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.39
GLA P06280 1/20 0.39
CYP2C19 P33261 1/20 0.39
GFER P55789 1/20 0.39
NOX1 Q9Y5S8 1/20 0.39
PSMD14 O00487 1/20 0.39
HK1 P19367 1/20 0.39
HKDC1 Q2TB90 1/20 0.39

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
SCHEMBL7995060 0.90 COMT (0.47) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7988044 0.89 NPC1 (0.47) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7989576 0.88 RAB9A (0.46) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7991845 0.87 SMN1; SMN2 (0.44) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7988275 0.86 MAPT (0.48) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7989593 0.85 MEN1 (0.56) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7977897 0.83 RAB9A (0.46) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
Hydrochloric Acid SCHEMBL7987780 0.83 MEN1 (0.55) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7991985 0.83 SMN1; SMN2 (0.46) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1
SCHEMBL7989018 0.81 MAPT (0.47) RAB9ANPC1SMN1; SMN2MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288061-B1 INTERLEUKIN INHIBITORS; ASTHMA, BRONCHODILATOR AGENTS, ANTIALLERGENS WELFIDE CORPORATION (JP) 2001-09-11 US disclosed