SCHEMBL1618677

SCHEMBL1618677

CC(C)(C)CC(C)(C)c1cccc(-n2nc3ccccc3n2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.46
HPGD P15428 4/20 0.46
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
HTT P42858 1/20 0.38
ALDH1A1 P00352 6/20 0.37
NPC1 O15118 6/20 0.37
RAB9A P51151 6/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
MAPT P10636 2/20 0.37
STAT1 P42224 1/20 0.37
SHBG P04278 1/20 0.35
SMN1; SMN2 Q16637 5/20 0.35
CASP3 P42574 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
NFKB1 P19838 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
CYP2D6 P10635 2/20 0.33

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
SCHEMBL22271031 0.83 KDM4E (0.41) KDM4EHPGDPPARGPPARAHTT
SCHEMBL4398146 0.82 KDM4E (0.36) KDM4EHPGDPPARGPPARAHTT
SCHEMBL30648256 0.82 KDM4E (0.53) KDM4EHPGDPPARGPPARAHTT
SCHEMBL29145880 0.82 KDM4E (0.53) KDM4EHPGDPPARGPPARAHTT
SCHEMBL3120584 0.81 KDM4E (0.39) KDM4EHPGDPPARGPPARAHTT
SCHEMBL1619971 0.81 HTT (0.35) HTTALDH1A1SHBGCYP2D6CYP2C9
SCHEMBL7655378 0.81 SHBG (0.42) KDM4EHPGDPPARGPPARAHTT
SCHEMBL28953938 0.78 PARP1 (0.31) PARP1
SCHEMBL28988179 0.76 HPGD (0.53) KDM4EHPGDHTTALDH1A1NPC1
SCHEMBL7900910 0.75 NPC1 (0.42) KDM4EHPGDPPARGPPARAHTT

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111621131-A Aromatic polycarbonate resin composition and optical molded article 住化PC有限公司 2020-09-04 CN disclosed
CN-111334020-A Aromatic polycarbonate resin composition and optical molded article 住化PC有限公司 2020-06-26 CN disclosed
CN-111267439-A Plate, preparation method of plate and use method of plate 十倍好智能家居(广州)有限公司 2020-06-12 CN disclosed
EP-1893718-B1 ELECTROLUMINESCENT METAL COMPLEXES WITH TRIAZOLES AND BENOTRIAZOLES UDC IRELAND LTD (IE) 2018-10-03 EP disclosed
EP-1966343-B1 ELECTROLUMINESCENT METAL COMPLEXES WITH TRIAZOLES UDC IRELAND LTD (IE) 2017-04-19 EP disclosed
EP-1966343-B1 ELECTROLUMINESCENT METAL COMPLEXES WITH TRIAZOLES UDC IRELAND LTD (IE) 2017-04-19 EP disclosed
CN-104145001-A Polycarbonate compositions containing conversion material chemicals and having enhanced optical properties, methods of making the same, and articles comprising the same SABIC INNOVATIVE PLASTICS IP 2014-11-12 CN disclosed
CN-101346451-B Electroluminescent metal complexes of triazoles CIBA HOLDING INC 2013-09-18 CN disclosed
US-8080667-B2 Electroluminescent metal complexes with triazoles and benzotriazoles BASF SE (DE) 2011-12-20 US disclosed
US-8080667-B2 Electroluminescent metal complexes with triazoles and benzotriazoles BASF SE (DE) 2011-12-20 US disclosed
US-20090062560-A1 Electroluminescent Metal Complexes With Triazoles CIBA CORPORATION (US) 2009-03-05 US disclosed
US-20090062560-A1 Electroluminescent Metal Complexes With Triazoles CIBA CORPORATION (US) 2009-03-05 US disclosed
US-20090062560-A1 Electroluminescent Metal Complexes With Triazoles CIBA CORPORATION (US) 2009-03-05 US disclosed
EP-1966343-A1 ELECTROLUMINESCENT METAL COMPLEXES WITH TRIAZOLES Ciba SC Holding AG (CH) 2008-09-10 EP disclosed
US-20080015355-A1 Electroluminescent Metal Complexes With Triazoles And Benzotriazoles UDC IRELAND LIMITED (IE) 2008-01-17 US disclosed
US-20080015355-A1 Electroluminescent Metal Complexes With Triazoles And Benzotriazoles UDC IRELAND LIMITED (IE) 2008-01-17 US disclosed
US-20080015355-A1 Electroluminescent Metal Complexes With Triazoles And Benzotriazoles UDC IRELAND LIMITED (IE) 2008-01-17 US disclosed
CN-101006161-A Electroluminescent metal complexes with triazoles and benzotriazoles CIBA SC HOLDING AG (CH) 2007-07-25 CN disclosed
WO-2007074093-A1 ELECTROLUMINESCENT METAL COMPLEXES WITH TRIAZOLES CIBA HOLDING INC. (CH) 2007-07-05 WO disclosed
WO-2007074093-A1 ELECTROLUMINESCENT METAL COMPLEXES WITH TRIAZOLES CIBA HOLDING INC. (CH) 2007-07-05 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-20080015355-A1 Electroluminescent Metal Complexes With Triazoles And Benzotriazoles OCIAD1, OXA1L, OCIAD2 KDM4E 4287/4885HPGD 783/4885PPARG 869/4885
US-20090062560-A1 Electroluminescent Metal Complexes With Triazoles OCIAD1, OCIAD2, CCND3 KDM4E 4281/4885HPGD 1163/4885PPARG 1440/4885

“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.