SCHEMBL4609040

SCHEMBL4609040

CCCc1ccc(Br)c(-c2cc(CC)c[c]c2CC)c1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ALOX5 P09917 1/20 0.33
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31

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
SCHEMBL4428503 0.76 CNR1 (0.34) CNR1CNR2ALOX5
SCHEMBL4609044 0.74 CNR1 (0.38) CNR1CNR2ALOX5
SCHEMBL15063932 0.71
SCHEMBL4428506 0.71 GABRA1 (0.34) ALOX5
SCHEMBL4607466 0.69
SCHEMBL6191444 0.69 CNR1 (0.67) CNR1CNR2ALOX5LPLLIPG
SCHEMBL2222176 0.69 GABRG2 (0.34)
SCHEMBL21677170 0.67 CNR1 (0.48) CNR1CNR2ALOX5LPLLIPG
SCHEMBL18830632 0.67 SKP2 (0.50) CNR1CNR2LPLLIPG
SCHEMBL4437892 0.66 L3MBTL1 (0.31)

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-1948649-A2 FUNGICIDAL CARBOXAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-07-30 EP disclosed
WO-2007014290-A2 FUNGICIDAL CARBOXAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-02-01 WO disclosed