SCHEMBL1794802

SCHEMBL1794802

S=C(Cc1ccccc1)N(c1ccccc1)c1cccc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.52
L3MBTL1 Q9Y468 3/20 0.47
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 2/20 0.36
HPGD P15428 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL1795399 0.82 SIGMAR1 (0.52) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL1794128 0.80 ALDH1A1 (0.50) L3MBTL1ALDH1A1KMT2AHPGDMEN1
SCHEMBL1795380 0.78 ALDH1A1 (0.48) L3MBTL1ALDH1A1KMT2AHPGDMEN1
SCHEMBL9317256 0.78 ALDH1A1 (0.59) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL13007114 0.78 SIGMAR1 (0.58) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL28821130 0.77 SIGMAR1 (0.61) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL3767488 0.76 SIGMAR1 (0.56) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL9317299 0.75 ALDH1A1 (0.59) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL3069182 0.75 SIGMAR1 (0.53) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL28017448 0.72 SIGMAR1 (0.55) SIGMAR1L3MBTL1CYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8221903-B2 Materials for N-type doping of the electron transporting layers in organic electronic devices OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2012-07-17 US disclosed
US-7951874-B2 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2011-05-31 US disclosed
US-7951874-B2 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2011-05-31 US disclosed
US-7951874-B2 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2011-05-31 US disclosed
US-7858724-B2 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2010-12-28 US disclosed
US-7858724-B2 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2010-12-28 US disclosed
US-7858724-B2 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2010-12-28 US disclosed
US-20080297035-A1 Novel Materials for N-Type Doping of the Electron Transporting Layers in Organic Electronic Devices DOLYA HOLDCO 5 LIMITED (IE) 2008-12-04 US disclosed
EP-1699898-B1 POLYMERIC, PHOSPHORESCENT, ORGANICALLY SEMI-CONDUCTIVE EMITTER MATERIALS BASED ON PERARYLATED BORANES, METHOD FOR THEIR PRODUCTION AND USE THEREOF OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2008-10-29 EP disclosed
US-20070191587-A1 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OLED GMBH (DE) 2007-08-16 US disclosed
US-20070191587-A1 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OLED GMBH (DE) 2007-08-16 US disclosed
US-20070191587-A1 Polymeric, phosphorescent, organically semi-conductive emitter materials based on perarylated boranes, method for their production and use thereof OSRAM OLED GMBH (DE) 2007-08-16 US disclosed
US-20060229431-A1 Non-conjugated polymeric perarylated boranes, use thereof as organically semiconductor transmitters and/or transport materials, methods for producing same and uses thereof OSRAM OLED GMBH (DE) 2006-10-12 US disclosed
US-7026490-B2 Amorphous organic 1,3,2-dioxaborine luminophores, method for the production and use thereof OSRAM OPTO SEMICONDUCTORS GMBH (DE) 2006-04-11 US disclosed
US-20040065867-A1 Amorphous organic 1,3,2-dioxaborine luminphores method for the production and use thereof OSRAM OLED GMBH (DE) 2004-04-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080297035-A1 Novel Materials for N-Type Doping of the Electron Transporting Layers in Organic Electronic Devices SLCO4C1, SLCO1A2, SLCO2A1 SIGMAR1 1818/4885L3MBTL1 2221/4885CYP1A2 1078/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.