SCHEMBL7977611

SCHEMBL7977611

CCCCNc1ccc(-c2nc(C(=O)Nc3nccs3)c(-c3cccc(OC)c3)[nH]2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
MAPT P10636 5/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
HTT P42858 2/20 0.44
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PSMD14 O00487 1/20 0.44
HK1 P19367 1/20 0.44
HKDC1 Q2TB90 1/20 0.44
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43

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
SCHEMBL7989961 0.94 MAPK1 (0.45) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7989590 0.92 MAPT (0.53) MAPK1L3MBTL1MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL7977698 0.91 MAPT (0.53) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7987889 0.90 MAPK1 (0.52) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7977760 0.88 MAPK1 (0.51) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7992126 0.87 NPC1 (0.46) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7992215 0.87 MAPT (0.55) MAPK1L3MBTL1MEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL7988824 0.86 MAPT (0.54) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7988807 0.86 ADORA2A (0.45) MAPK1L3MBTL1MEN1KMT2AMAPT
SCHEMBL7992383 0.86 L3MBTL1 (0.51) MAPK1L3MBTL1MEN1KMT2AMAPT

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