SCHEMBL2399644

SCHEMBL2399644

OB(O)c1cc2c3ccccc3c(B(O)O)cc2c2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
ENPP2 Q13822 2/20 0.41
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CA5B Q9Y2D0 1/20 0.39
LIPG Q9Y5X9 1/20 0.39
LIPE Q05469 1/20 0.38
TRPM4 Q8TD43 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
IDO1 P14902 1/20 0.35
CYP1A2 P05177 1/20 0.35
ORAI1 Q96D31 1/20 0.34
ORAI2 Q96SN7 1/20 0.34
ORAI3 Q9BRQ5 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL2469874 0.87 MAPT (0.42) MAPTENPP2CA4CA6CA5A
SCHEMBL31576187 0.87 MAPT (0.42) MAPTENPP2CA4CA6CA5A
SCHEMBL18253940 0.87 HPRT1 (0.58) MAPTTRPM4CA1CA2CYP1A2
SCHEMBL31286368 0.87 HPRT1 (0.58) MAPTTRPM4CA1CA2CYP1A2
SCHEMBL1753911 0.87 HPRT1 (0.58) MAPTTRPM4CA1CA2CYP1A2
SCHEMBL29875461 0.82 MAPT (0.50) MAPTENPP2CA4CA6CA5A
SCHEMBL1427222 0.82 MAPT (0.50) MAPTENPP2CA4CA6CA5A
SCHEMBL368234 0.82 TRPM4 (0.54) MAPTTRPM4CA1CA2CYP1A2
SCHEMBL12432018 0.79 CA4 (0.34) MAPTENPP2CA4CA6CA5A
SCHEMBL2627637 0.79 MAPT (0.31) MAPTTRPM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 US disclosed
US-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 US disclosed
US-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 US disclosed
US-8021766-B2 layer containing an organic compound sandwiched between the pair of electrodes; high color purity, high efficiency, high luminance, and a long life; nonaggregate; cost efficiency CANON KABUSHIKI KAISHA (JP) 2011-09-20 US disclosed
US-20080286611-A1 BENZO(GHI)FLUORANTHENE DERIVATIVE AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2008-11-20 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 (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-20080286611-A1 BENZO(GHI)FLUORANTHENE DERIVATIVE AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME GTF2I, FLI1, GLB1 MAPT 2285/4885ENPP2 4252/4885CA4 2241/4885
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE CRY1, CYP1A1, CRY2 MAPT 1223/4885ENPP2 4095/4885CA4 3682/4885

“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.