SCHEMBL7991587

SCHEMBL7991587

Nc1ccc(-c2nc(C(=O)Nc3nccs3)c(-c3ccc(N)cc3)[nH]2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.57
NPC1 O15118 5/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
LMNA P02545 2/20 0.57
RECQL P46063 1/20 0.57
MAPK1 P28482 2/20 0.47
POLB P06746 1/20 0.47
TSHR P16473 1/20 0.47
ALDH1A1 P00352 4/20 0.46
GAA P10253 2/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
MAPT P10636 3/20 0.46
HPGD P15428 2/20 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
METAP2 P50579 1/20 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
SCHEMBL7991665 0.96 RAB9A (0.53) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7991953 0.95 RAB9A (0.52) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7977923 0.95 MEN1 (0.52) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7977950 0.95 MAPT (0.53) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7994909 0.92 RAB9A (0.52) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7977759 0.92 MEN1 (0.57) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7977619 0.92 RAB9A (0.52) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
Hydrochloric Acid SCHEMBL7988505 0.91 RAB9A (0.51) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7977809 0.90 RAB9A (0.51) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA
SCHEMBL7991875 0.86 RAB9A (0.47) RAB9ANPC1SMN1; SMN2L3MBTL1LMNA

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