SCHEMBL7769424

SCHEMBL7769424

O=C(c1ccc(Br)cc1)c1ccc(OCC=CCNCO)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LSS P48449 8/20 0.56
PPARD Q03181 2/20 0.46
MAPT P10636 2/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
SRD5A2 P31213 1/20 0.45
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
MAOB P27338 1/20 0.43
POLB P06746 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
SCHEMBL7688510 1.00 LSS (0.56) LSSPPARDMAPTMEN1LMNA
SCHEMBL8050168 0.86 LSS (0.56) LSSPPARDMAPTMEN1LMNA
SCHEMBL7688375 0.85 LSS (0.60) LSSPPARDMAPTMEN1LMNA
SCHEMBL7688373 0.85 LSS (0.60) LSSPPARDMAPTMEN1LMNA
SCHEMBL7771941 0.85 LSS (0.60) LSSPPARDMAPTMEN1LMNA
SCHEMBL7679275 0.85 LSS (0.60) LSSPPARDMAPTMEN1LMNA
SCHEMBL8035630 0.84 LSS (0.60) LSSPPARDMAPTMEN1LMNA
SCHEMBL7768109 0.82 LSS (0.56) LSSPPARDMAPTMEN1LMNA
SCHEMBL7686218 0.82 LSS (0.62) LSSPPARDMAPTMEN1LMNA
SCHEMBL7686216 0.82 LSS (0.62) LSSPPARDMAPTMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0778264-B1 Tertiary amines having antimycotic and cholesterol lowering activity HOFFMANN LA ROCHE (CH) 2001-07-11 EP claimed