SCHEMBL7367741

SCHEMBL7367741

O=c1cc(-c2ccccc2)oc2c(Br)c(O)c(Br)c(O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 4/20 1.00
GABRD O14764 4/20 1.00
GABRA1 P14867 4/20 1.00
GABRB1 P18505 4/20 1.00
GABRG2 P18507 4/20 1.00
GABRB3 P28472 4/20 1.00
GABRA5 P31644 4/20 1.00
GABRA3 P34903 4/20 1.00
GABRA2 P47869 4/20 1.00
GABRB2 P47870 4/20 1.00
GABRA4 P48169 4/20 1.00
GABRE P78334 4/20 1.00
GABRA6 Q16445 4/20 1.00
GABRG1 Q8N1C3 4/20 1.00
GABRG3 Q99928 4/20 1.00
GABRQ Q9UN88 4/20 1.00
ABCB1 P08183 7/20 0.56
MAPT P10636 6/20 0.54
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 5/20 0.54

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
SCHEMBL971674 0.91 GABRP (0.84) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29149073 0.82 GABRP (0.70) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL27974348 0.81 MAPT (0.77) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7371778 0.81 GABRP (0.67) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL21318438 0.79 GABRP (0.65) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL973228 0.79 CREB1 (0.65) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7375373 0.78 GABRP (0.64) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10013320 0.77 ABCB1 (0.64) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6725127 0.77 GABRP (0.62) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL31632254 0.76 GABRP (0.61) GABRPGABRDGABRA1GABRB1GABRG2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714296-B1 FLAVONOID AND BIFLAVONOID DERIVATIVES, THEIR PHARMACEUTICAL COMPOSITIONS, THEIR ANXIOLYTIC ACTIVITY UNIV STRATHCLYDE (GB) 2001-11-07 EP disclosed
US-6004998-A FLAVONOID 6,8-DIBROMOCHRYSIN UNIVERSITY OF STRATHCLYDE (GB) 1999-12-21 US disclosed
US-5756538-A REDUCING THE SEDATIVE AND RELAXANT SIDE EFFECT UNIVERSITY OF STRATHCLYDE (GB) 1998-05-26 US disclosed
EP-0714296-A1 FLAVONOID AND BIFLAVONOID DERIVATIVES, THEIR PHARMACEUTICAL COMPOSITIONS, THEIR ANXIOLYTIC ACTIVITY UNIVERSITY OF STRATHCLYDE (GB) 1996-06-05 EP disclosed
WO-1995005169-A1 FLAVONOID AND BIFLAVONOID DERIVATIVES, THEIR PHARMACEUTICAL COMPOSITIONS, THEIR ANXIOLYTIC ACTIVITY THE UNIVERSITY OF STRATHCLYDE (GB) 1995-02-23 WO disclosed