SCHEMBL6859684

SCHEMBL6859684

Cc1ccccc1-c1ccc2ccccc2n1.Cc1ccccc1-c1ccc2ccccc2n1.[Ir]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 10/20 0.62
NPC1 O15118 6/20 0.53
RAB9A P51151 6/20 0.53
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
POLB P06746 3/20 0.53
LMNA P02545 1/20 0.53
CYP1A2 P05177 2/20 0.50
PTGS2 P35354 1/20 0.50
MAPT P10636 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HCRTR1 O43613 1/20 0.49
TP53 P04637 1/20 0.49
PKM P14618 1/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL29986262 0.98 AR (0.64) ARNPC1RAB9AMEN1KMT2A
SCHEMBL4788772 0.98 AR (0.64) ARNPC1RAB9AMEN1KMT2A
SCHEMBL29986356 0.85 AR (0.59) ARNPC1RAB9AMEN1KMT2A
SCHEMBL29986008 0.84 AR (0.57) ARNPC1RAB9AMEN1KMT2A
SCHEMBL28850555 0.84 NPC1 (0.59) ARNPC1RAB9AMEN1KMT2A
Trifluoroacetic Acid SCHEMBL4479326 0.83 AR (0.50) ARNPC1RAB9AMEN1KMT2A
SCHEMBL30273432 0.81 ESR1 (0.54) ARNPC1RAB9AMEN1KMT2A
SCHEMBL13989422 0.81 ESR1 (0.54) ARNPC1RAB9AMEN1KMT2A
SCHEMBL12853993 0.81 PTGS2 (0.57) ARNPC1RAB9AMEN1KMT2A
SCHEMBL12319823 0.80 AR (0.57) ARNPC1RAB9AMEN1KMT2A

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
US-6835469-B2 Phosphorescent compounds and devices comprising the same THE UNIVERSITY OF SOUTHERN CALIFORNIA 2004-12-28 US disclosed