SCHEMBL1345858

SCHEMBL1345858

CC(=O)c1nccn1Cc1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.58
NPC1 O15118 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ALDH1A1 P00352 1/20 0.52
LMNA P02545 2/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
FDPS P14324 1/20 0.48
NOTUM Q6P988 1/20 0.46
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HSP90AA1 P07900 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL418384 0.90 RAB9A (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL13389039 0.84 RAB9A (0.55) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL3313595 0.84 ALDH1A1 (0.59) RAB9ANPC1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL29515990 0.84 RAB9A (0.54) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL13379459 0.83 RAB9A (0.54) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL17381155 0.83 RAB9A (0.57) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL5851274 0.83 RAB9A (0.53) RAB9ANPC1SMN1; SMN2ALDH1A1OPRD1
SCHEMBL14302377 0.81 RAB9A (0.52) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL8503637 0.81 RAB9A (0.55) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL1593910 0.81 SMN1; SMN2 (0.55) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8062767-B2 Organic light emitting diode containing a Ir complex having a novel ligand as a phosphorescent emitter Cheng, Chien-Hong (TW) 2011-11-22 US disclosed
US-8062767-B2 Organic light emitting diode containing a Ir complex having a novel ligand as a phosphorescent emitter Cheng, Chien-Hong (TW) 2011-11-22 US disclosed
US-8062767-B2 Organic light emitting diode containing a Ir complex having a novel ligand as a phosphorescent emitter Cheng, Chien-Hong (TW) 2011-11-22 US disclosed
US-20080217606-A1 Organic light emitting diode containing a Ir complex having a novel ligand as a phosphorescent emitter Cheng, Chien-Hong (TW) 2008-09-11 US disclosed
US-20080217606-A1 Organic light emitting diode containing a Ir complex having a novel ligand as a phosphorescent emitter Cheng, Chien-Hong (TW) 2008-09-11 US disclosed
US-20080217606-A1 Organic light emitting diode containing a Ir complex having a novel ligand as a phosphorescent emitter Cheng, Chien-Hong (TW) 2008-09-11 US disclosed