SCHEMBL8310084

SCHEMBL8310084

COc1ccc2oc(C(=O)NC3CCCCNC3=O)cc2c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 5/20 0.57
TAS1R1 Q7RTX1 5/20 0.57
HPGDS O60760 3/20 0.55
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
KDM4E B2RXH2 4/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
RECQL P46063 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 3/20 0.47
GAA P10253 2/20 0.47
HPGD P15428 2/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNA7 P36544 1/20 0.47
CHRNA4 P43681 1/20 0.47

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
SCHEMBL14856185 0.78 RAB9A (0.74) HPGDSRAB9ANPC1KDM4EALDH1A1
SCHEMBL15087626 0.78 RAB9A (0.74) HPGDSRAB9ANPC1KDM4EALDH1A1
SCHEMBL4199832 0.77 TAS1R3 (0.79) TAS1R3TAS1R1RAB9ANPC1KDM4E
SCHEMBL24470901 0.74 GAA (0.58) HPGDSRAB9ANPC1KDM4EGAA
SCHEMBL14856272 0.74 RAB9A (0.68) HPGDSRAB9ANPC1KDM4EALDH1A1
SCHEMBL15087631 0.74 RAB9A (0.68) HPGDSRAB9ANPC1KDM4EALDH1A1
SCHEMBL29362997 0.73 TAS1R3 (0.73) TAS1R3TAS1R1KDM4EHSD17B10MEN1
SCHEMBL24522315 0.73 TAS1R3 (0.73) TAS1R3TAS1R1KDM4EHSD17B10MEN1
SCHEMBL10246958 0.73 MEN1 (0.53) TAS1R3TAS1R1MEN1KMT2AALDH1A1
SCHEMBL703306 0.73 TAS1R3 (1.00) TAS1R3TAS1R1KDM4EHSD17B10ALDH1A1

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