SCHEMBL153284

SCHEMBL153284

O=C(c1ccccc1)c1ccc(Cl)cc1I

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
ALDH1A1 P00352 3/20 0.52
LMNA P02545 1/20 0.52
NR4A1 P22736 1/20 0.51
SRD5A2 P31213 1/20 0.51
MITF O75030 1/20 0.51
HSP90AA1 P07900 1/20 0.51
HTT P42858 1/20 0.51
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TLR9 Q9NR96 1/20 0.51
TP53 P04637 2/20 0.50
SERPINE1 P05121 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
S100B P04271 1/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 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
SCHEMBL10994311 0.86 MAPT (0.57) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL28157462 0.83 NR4A1 (0.61) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL29350361 0.81 SRD5A2 (0.74) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL522683 0.81 SRD5A2 (0.74) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL4712301 0.80 NR4A1 (0.68) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL3956037 0.80 NR4A1 (0.68) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL460727 0.80 MEN1 (0.68) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL499643 0.79 SMN1; SMN2 (0.63) ALDH1A1NR4A1SRD5A2NPSR1TP53
SCHEMBL9565886 0.79 SRD5A2 (0.51) MAPTALDH1A1LMNANR4A1SRD5A2
SCHEMBL31366555 0.79 MAPT (0.61) MAPTALDH1A1LMNANR4A1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
EP-2427431-B1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2013-05-01 EP disclosed
EP-2427431-A1 NOVEL INDICATOR PLATFORM Biosynth AG (CH) 2012-03-14 EP disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed
WO-2010128120-A1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2010-11-11 WO disclosed
US-5098901-A Cardiovascular disorders STERLING DRUG INC. (US) 1992-03-24 US disclosed