SCHEMBL8314504

SCHEMBL8314504

COc1ccc2oc(-c3nc(C)cs3)cc2c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.70
NPC1 O15118 3/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
MAPT P10636 2/20 0.70
KDM4E B2RXH2 2/20 0.70
ALDH1A1 P00352 1/20 0.70
HPGD P15428 1/20 0.70
APP P05067 4/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
HIF1A Q16665 1/20 0.51
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
F2RL3 Q96RI0 3/20 0.46
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
PTGES O14684 1/20 0.43
CYP2A6 P11509 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
SCHEMBL8310999 0.83 KDM4E (0.50) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8310435 0.82 KDM4E (0.49) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8312888 0.81 MAPT (0.56) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8310912 0.80 MIF (0.54) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8696641 0.79 F2RL3 (0.53) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8317400 0.79 MAPT (0.46) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8314545 0.79 MAOB (0.56) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8310447 0.78 CYP19A1 (0.50) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8310753 0.77 ALDH1A1 (0.45) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL8310423 0.76 SMN1; SMN2 (0.44) RAB9ANPC1SMN1; SMN2MAPTKDM4E

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-0528337-B1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1999-10-20 EP disclosed
US-5296495-A Antiallergens, antiinflammatory FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-22 US disclosed
EP-0528337-A1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-24 EP disclosed