SCHEMBL1742271

SCHEMBL1742271

CC(CCc1cccc(Br)c1)c1cccc(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.50
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SIGMAR1 Q99720 2/20 0.42
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
PARP1 P09874 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL13538390 0.82 SIGMAR1 (0.52) TAAR1MEN1KMT2ASIGMAR1MAOB
SCHEMBL13220639 0.82 TAAR1 (0.57) TAAR1MEN1KMT2ASIGMAR1IDO1
SCHEMBL19524579 0.81 SIGMAR1 (0.51) TAAR1MEN1KMT2ASIGMAR1MAOB
SCHEMBL21726124 0.80 PARP1 (0.42) IDO1PARP1
SCHEMBL15721667 0.80 PARP1 (0.42) IDO1PARP1
SCHEMBL27407790 0.80 RIPK1 (0.48) TAAR1MEN1KMT2AIDO1PARP1
SCHEMBL26874493 0.79 PARP1 (0.41) IDO1PARP1
SCHEMBL15427659 0.79 TRPA1 (0.44) IDO1PARP1
SCHEMBL8208663 0.77 TAAR1 (0.52) TAAR1MEN1KMT2AIDO1
SCHEMBL2758515 0.76 HDAC4 (0.53) MEN1KMT2AIDO1PARP1

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-2385940-A1 2,4,6-TRI-(HETEROARYLPHENYL)-PYRIDINES AND ELECTRON-TRANSPORTING MATERIALS COMPRISING THEM General Electric Company (US) 2011-11-16 EP disclosed
US-8041982-B2 Real time clock TEXAS INSTRUMENTS INCORPORATED (US) 2011-10-18 US disclosed
WO-2010080471-A1 2,4,6-TRI-(HETEROARYLPHENYL)-PYRIDINES AND ELECTRON-TRANSPORTING MATERIALS COMPRISING THEM GENERAL ELECTRIC COMPANY (US) 2010-07-15 WO disclosed