SCHEMBL7991541

SCHEMBL7991541

CN(C)c1ccc(-c2[nH]c(-c3cccc4ccccc34)nc2C(=O)Nc2nccs2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
NPC1 O15118 5/20 0.44
MAPK1 P28482 3/20 0.44
TSHR P16473 2/20 0.44
POLB P06746 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.43
AURKA O14965 1/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
GBA1 P04062 1/20 0.41
MAPK10 P53779 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41

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
SCHEMBL6707244 0.90 RAB9A (0.48) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7977710 0.90 RAB9A (0.52) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7991983 0.88 MAPK13 (0.50) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7991875 0.88 RAB9A (0.47) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7994926 0.88 RAB9A (0.45) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7995180 0.88 MAPK1 (0.53) RAB9AMEN1KMT2ANPC1MAPK1
Hydrochloric Acid SCHEMBL7991518 0.87 MEN1 (0.49) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7977588 0.86 SIRT2 (0.43) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7988277 0.86 SIRT2 (0.43) RAB9AMEN1KMT2ANPC1MAPK1
SCHEMBL7987908 0.85 NPC1 (0.51) RAB9AMEN1KMT2ANPC1MAPK1

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