SCHEMBL5553797

SCHEMBL5553797

Cc1cc(C)c(B(c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)c2)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 13/20 0.43
FFAR4 Q5NUL3 1/20 0.33
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
MEN1 O00255 1/20 0.31
MPI P34949 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL7459339 0.89 RAPGEF4 (0.38) RAPGEF4
SCHEMBL7457901 0.89 RAPGEF4 (0.44) RAPGEF4FFAR4
SCHEMBL12551743 0.87 RAPGEF4 (0.34) RAPGEF4ALDH1A1
SCHEMBL85680 0.86 RAPGEF4 (0.42) RAPGEF4FFAR4CYP1A2CYP2A6
SCHEMBL5553806 0.85 RAPGEF4 (0.38) RAPGEF4FFAR4CYP1A2CYP2A6
SCHEMBL1157695 0.85 RAPGEF4 (0.50) RAPGEF4ALDH1A1KDM4EMAPTLMNA
SCHEMBL7461430 0.85 RAPGEF4 (0.33) RAPGEF4
SCHEMBL7461325 0.84 RAPGEF4 (0.38) RAPGEF4
SCHEMBL12551740 0.83 ALDH1A1 (0.36) RAPGEF4FFAR4ALDH1A1KDM4ELMNA
SCHEMBL9623685 0.82 RAPGEF4 (0.48) RAPGEF4FFAR4ALDH1A1KDM4EMAPT

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
US-8178214-B2 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2012-05-15 US disclosed
US-8178214-B2 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2012-05-15 US disclosed
US-7279603-B2 Boron and aluminum compounds in electronic components MERCK PATENT GMBH (DE) 2007-10-09 US disclosed
US-20070184301-A1 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-09 US disclosed
US-20070184301-A1 Material for organic electroluminescence element, organic electroluminescence element, display device and illumination device KONICA MINOLTA HOLDINGS, INC. (JP) 2007-08-09 US disclosed
US-20060241321-A1 Use of boron and aluminium compounds in electronic components COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-10-26 US disclosed
US-7060369-B2 Use of boron and aluminum compounds in electronic components COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2006-06-13 US disclosed
US-20040058194-A1 Use of boron and aluminium compounds in electronic components MERCK PATENT GMBH (DE) 2004-03-25 US disclosed
EP-1217668-A1 Use of boron and aluminium compounds in electronic devices Covion Organic Semiconductors GmbH (DE) 2002-06-26 EP disclosed
EP-0775706-B1 Borates photoinitiators from polyboranes CIBA SC HOLDING AG (CH) 2002-06-05 EP disclosed
EP-1203999-A2 Photoinitiator comprising a borane and an electron donating compound Ciba SC Holding AG (CH) 2002-05-08 EP disclosed
US-6057078-A PHOTOGRAPHY CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-05-02 US disclosed
US-5807905-A POLYMERIZATION OF UNSATURATED COMPOUNDS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-09-15 US disclosed
EP-0775706-A2 Borates photoinitiators from polyboranes Ciba SC Holding AG (CH) 1997-05-28 EP 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-20060241321-A1 Use of boron and aluminium compounds in electronic components SLCO4C1, SLC43A3, OSBP2 RAPGEF4 659/4885FFAR4 3398/4885ALDH1A1 4488/4885
US-20040058194-A1 Use of boron and aluminium compounds in electronic components SLCO4C1, SLC43A3, OSBP2 RAPGEF4 659/4885FFAR4 3398/4885ALDH1A1 4488/4885

“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.