SCHEMBL8965191

SCHEMBL8965191

Fc1ccc(-c2cccc(Br)c2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRP O00591 1/20 0.44
GABRD O14764 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRB1 P18505 1/20 0.44
GABRA2 P47869 1/20 0.44
GABRB2 P47870 1/20 0.44
GABRA4 P48169 1/20 0.44
GABRE P78334 1/20 0.44
GABRA6 Q16445 1/20 0.44
GABRG1 Q8N1C3 1/20 0.44
GABRG3 Q99928 1/20 0.44
GABRQ Q9UN88 1/20 0.44
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42

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
SCHEMBL30753844 1.00 CNR1 (0.44) CNR1GABRG2GABRB3GABRA5GABRA3
SCHEMBL10269901 0.85 ALOX5AP (0.45) CNR1GABRG2GABRB3GABRA5GABRA3
SCHEMBL14926547 0.84 CNR1 (0.49) CNR1GABRG2GABRB3GABRA5GABRA3
SCHEMBL15495645 0.82 CNR1 (0.48) CNR1GABRG2GABRB3GABRA5GABRA3
SCHEMBL30404433 0.81 LMNA (0.43) CNR1GABRG2GABRB3GABRA5GABRA3
SCHEMBL28931963 0.81 LMNA (0.43) CNR1GABRG2GABRB3GABRA5GABRA3
SCHEMBL27655365 0.80 SMN1; SMN2 (0.54) GABRG2GABRB3GABRA5GABRA3GABRP
SCHEMBL20546438 0.78 TTR (0.41) CNR1KDM4EMEN1USP2ALDH1A1
SCHEMBL28513713 0.78 GABRP (0.42) GABRG2GABRB3GABRA5GABRA3GABRP
SCHEMBL28663709 0.78 GABRP (0.42) GABRG2GABRB3GABRA5GABRA3GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0696271-A1 CYCLOOXYGENASE AND 5-LIPOXYGENASE INHIBITING HYDROXAMIC ACID DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1996-02-14 EP disclosed
WO-1994025430-A1 CYCLOOXYGENASE AND 5-LIPOXYGENASE INHIBITING HYDROXAMIC ACID DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1994-11-10 WO disclosed