SCHEMBL7573660

SCHEMBL7573660

O=C(Nc1ccc(Cl)cc1)c1[c]cccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.46
RAB9A P51151 4/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
IDO1 P14902 1/20 0.45
MAPK1 P28482 1/20 0.45
P2RX1 P51575 1/20 0.44
SMO Q99835 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.43
NPY1R P25929 1/20 0.43
NPY2R P49146 1/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.42
EPHX1 P07099 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42

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
SCHEMBL7583446 0.88 KMT2A (0.50) NPC1RAB9ALMNAHTTSMO
SCHEMBL7574535 0.84 F10 (0.45) NPC1RAB9ALMNAHTTMAPK1
SCHEMBL7585606 0.76 ALDH1A1 (0.39) NPC1RAB9ASMN1; SMN2MAPTL3MBTL1
SCHEMBL7583871 0.75 NPC1 (0.51) NPC1RAB9ALMNAHTTMAPK1
SCHEMBL2117583 0.73 SMO (0.75) NPC1RAB9ALMNAMAPK1SMO
SCHEMBL1181086 0.71 ALDH1A1 (0.45) MAPK1SMN1; SMN2NPSR1MEN1KMT2A
SCHEMBL7573916 0.71 MAPK1 (0.53) NPC1RAB9ALMNAHTTMAPK1
SCHEMBL1968479 0.69 NR4A2 (0.41) NPC1RAB9ALMNAHTTMAPK1
SCHEMBL7574566 0.69 MAPK1 (0.64) NPC1RAB9ALMNAMAPK1SMN1; SMN2
SCHEMBL10939703 0.69 NPC1 (0.76) NPC1RAB9ALMNAMAPK1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882730-B1 PHOSPHONIC ACID DIESTER DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2002-10-02 EP disclosed
US-5985858-A TREATING AND PREVENTING HYPERLIPIDEMIA, DIABETES AND CATARACT, OR AS AN ANTITUMOR AGENT OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 US disclosed
EP-0882730-A1 PHOSPHONIC ACID DIESTER DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-12-09 EP disclosed