SCHEMBL6175024

SCHEMBL6175024

O=C(O)c1cccc2c(=O)cc(-c3cccc(OCc4ccccc4)c3)oc12

nearest known ligand 0.82

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 7/20 0.71
PRKDC P78527 2/20 0.51
SLC16A3 O15427 1/20 0.49
ABCB1 P08183 1/20 0.49
MAPT P10636 1/20 0.49
ATM Q13315 1/20 0.48
CYP1A1 P04798 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP1B1 Q16678 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.48
CTSV O60911 1/20 0.47
CTSL P07711 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
SCHEMBL6174522 0.90 CYSLTR1 (0.73) CYSLTR1PRKDCSLC16A3ABCB1MAPT
SCHEMBL6177306 0.88 CYSLTR1 (0.57) CYSLTR1PRKDC
SCHEMBL6176769 0.83 CYSLTR1 (1.00) CYSLTR1
SCHEMBL8807539 0.83 CYSLTR1 (0.69) CYSLTR1ABCB1MAPTCYP1A1CYP1A2
SCHEMBL1516397 0.82 CYSLTR1 (0.78) CYSLTR1PRKDCABCB1MAPTCYP1A1
Hydrochloric Acid SCHEMBL10993975 0.82 CYSLTR1 (0.67) CYSLTR1ABCB1MAPTCYP1A1CYP1A2
SCHEMBL6179898 0.81 CYSLTR1 (0.73) CYSLTR1PRKDCABCB1MAPTCYP1A1
Hydrochloric Acid SCHEMBL10995142 0.81 CYSLTR1 (0.76) CYSLTR1PRKDCABCB1MAPTCYP1A1
SCHEMBL6176758 0.80 CYSLTR1 (0.75) CYSLTR1
SCHEMBL6176722 0.79 CYSLTR1 (0.57) CYSLTR1PRKDCABCB1MAPTCYP1A1

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