SCHEMBL443891

SCHEMBL443891

c1ccc(-c2ccc3c(n2)oc2ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
RAB9A P51151 2/20 0.42
TDO2 P48775 1/20 0.40
HPGD P15428 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA12 O43570 2/20 0.39
TP53 P04637 2/20 0.39
ABCB1 P08183 2/20 0.39
CYP3A4 P08684 2/20 0.39
ADORA3 P0DMS8 2/20 0.39
AR P10275 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CYP1B1 Q16678 2/20 0.39
CA9 Q16790 2/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
NPC1 O15118 1/20 0.39
TNKS O95271 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
SCHEMBL31439258 1.00 MEN1 (0.42) MEN1KMT2ARAB9ATDO2HPGD
SCHEMBL24057196 0.88 TBK1 (0.34) MEN1KMT2ARAB9ATDO2HPGD
SCHEMBL26834213 0.87 AHR (0.49) MEN1KMT2ARAB9AHPGDCA1
SCHEMBL26424274 0.87 TNKS (0.44) MEN1KMT2ARAB9ASMN1; SMN2CYP1B1
SCHEMBL25663343 0.87 MEN1 (0.47) MEN1KMT2ARAB9AHPGDTP53
SCHEMBL25662863 0.85 TNKS (0.35) MEN1KMT2ARAB9ATDO2HPGD
SCHEMBL25462978 0.83 MEN1 (0.39) MEN1KMT2ARAB9AHPGDTP53
SCHEMBL25462969 0.82 KMT2A (0.38) MEN1KMT2ARAB9AHPGDTP53
SCHEMBL23972148 0.81 KMT2A (0.38) MEN1KMT2ARAB9ATDO2HPGD
SCHEMBL24057488 0.81 CYP1A1 (0.37) MEN1KMT2AHPGDTP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105820192-B Metal complexes comprising novel ligand structures 通用显示公司 2020-04-07 CN disclosed
US-20170237019-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2017-08-17 US disclosed
US-9634264-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-04-25 US disclosed
US-9359549-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-06-07 US disclosed
US-9359549-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-06-07 US disclosed
US-9359549-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2016-06-07 US disclosed
US-20140131663-A1 Iridium Complexes With Aza-Benzo Fused Ligands UNIVERSAL DISPLAY CORPORATION (US) 2014-05-15 US disclosed
EP-2417215-B1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORP (US) 2014-05-07 EP disclosed
US-20120061654-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2012-03-15 US disclosed
US-20120061654-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2012-03-15 US disclosed
US-20120061654-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2012-03-15 US disclosed
EP-2417215-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES Universal Display Corporation (US) 2012-02-15 EP disclosed
WO-2010118029-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2010-10-14 WO disclosed
WO-2010118029-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES UNIVERSAL DISPLAY CORPORATION (US) 2010-10-14 WO 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 (2 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-20120061654-A1 METAL COMPLEX COMPRISING NOVEL LIGAND STRUCTURES ZFX, VDAC1, PDCD1LG2 MEN1 1853/4885KMT2A 625/4885RAB9A 2332/4885
US-20170237019-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP MEN1 4723/4885KMT2A 2518/4885RAB9A 1851/4885

“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.