SCHEMBL6176852

SCHEMBL6176852

CCOC(=O)c1cc(Br)cc2c(=O)cc(-c3cccc(OCc4nc5ccccc5n4C)c3)oc12

nearest known ligand 0.83

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 11/20 0.57
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
TP53 P04637 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYSLTR2 Q9NS75 1/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL6174519 0.91 CYSLTR1 (0.69) CYSLTR1NPC1RAB9ATP53SMN1; SMN2
SCHEMBL6177251 0.84 CYSLTR1 (0.81) CYSLTR1CYSLTR2
SCHEMBL6174892 0.83 CYSLTR1 (0.81) CYSLTR1CYSLTR2
SCHEMBL6176265 0.83 CYSLTR1 (0.58) CYSLTR1NPC1RAB9ACYSLTR2
SCHEMBL6176271 0.82 CYSLTR1 (0.61) CYSLTR1
SCHEMBL6176136 0.79 CYSLTR1 (0.82) CYSLTR1CYSLTR2
SCHEMBL6175049 0.78 CYSLTR1 (0.50) CYSLTR1TP53SMN1; SMN2
SCHEMBL6175933 0.78 GABRP (0.56) CYSLTR1TP53SMN1; SMN2
SCHEMBL6176262 0.75 CYSLTR1 (0.48) CYSLTR1
SCHEMBL6175860 0.74 CYSLTR1 (0.80) CYSLTR1CYSLTR2

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-0834510-B1 Flavone derivative and medicine comprising the same KOWA CO (JP) 2005-02-23 EP disclosed
US-6136848-A ANTIALLERGENS; ASTHMA THERAPY KOWA CO., LTD. (JP) 2000-10-24 US disclosed
EP-0834510-A2 Flavone derivative and medicine comprising the same KOWA CO. LTD. (JP) 1998-04-08 EP disclosed