SCHEMBL5134192

SCHEMBL5134192

c1ccc([C@H]2OB(c3ccccc3B3O[C@H](c4ccccc4)[C@@H](c4ccccc4)O3)O[C@@H]2c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.37
▸ EPHX1 P07099 3/20 0.33
▸ CYP2C19 P33261 5/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SLC6A2 P23975 2/20 0.31
▸ ADRA1A P35348 2/20 0.31
▸ SLC6A3 Q01959 2/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ MAOA P21397 5/20 0.31
▸ MAOB P27338 5/20 0.31
▸ KDM1A O60341 4/20 0.31
▸ CYP2B6 P20813 3/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ CYP2D6 P10635 2/20 0.31
▸ CYP2C9 P11712 2/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ ADRA2A P08913 1/20 0.31

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
SCHEMBL24017021 0.76 TSHR (0.42) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL12327931 0.72 TSHR (0.39) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL12295813 0.67 EPHX1 (0.39) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL3644410 0.66 EPHX1 (0.52) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL12914371 0.66 EPHX1 (0.52) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL270441 0.66 EPHX1 (0.52) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL63809 0.66 EPHX1 (0.52) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL1199046 0.66 EPHX1 (0.52) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL1103798 0.66 EPHX1 (0.52) TSHREPHX1CYP2C19MEN1KMT2A
SCHEMBL6571126 0.66 TSHR (0.48) TSHREPHX1CYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392504-A4 SENSOR SURFACES FOR DETECTING ANALYTES AGILENT TECHNOLOGIES INC (US) 2008-03-05 — — EP disclosed
US-7208322-B2 Sensor surfaces for detecting analytes AGILENT TECHNOLOGIES, INC. (US) 2007-04-24 — — US disclosed
US-7179659-B2 Detection of preferential particles in sample; obtain sample, incubate with sensor and substrate, monitor and measure response, evaluate for presence of particle AGILENT TECHNOLOGIES, INC. (US) 2007-02-20 — — US disclosed
EP-1392504-A1 SENSOR SURFACES FOR DETECTING ANALYTES Prolinx Incorporated (US) 2004-03-03 — — EP disclosed
US-6630577-B2 Useful for producing bioconjugates PROLINX, INC. 2003-10-07 — — US disclosed
US-20030032202-A1 Sensor surfaces for detecting analytes and methods of use PROLINX INCORPORATED (US) 2003-02-13 — — US disclosed
US-20020192722-A1 Sensor surfaces for detecting analytes PROLINX INCORPORATED (US) 2002-12-19 — — US disclosed
EP-1264833-A2 1,2-Phenylenediboronic acid reagents and complexes PROLINX, INC. (US) 2002-12-11 — — EP disclosed
WO-2002078947-A1 SENSOR SURFACES FOR DETECTING ANALYTES PROLINX INCORPORATED (US) 2002-10-10 — — WO disclosed
US-20020038004-A1 1,2-phenylenediboronic acid reagents and complexes PROLINX, INC. 2002-03-28 — — 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-20020038004-A1 1,2-phenylenediboronic acid reagents and complexes BCR, MGST1, SULT1E1 TSHR 775/4885EPHX1 1159/4885CYP2C19 215/4885

“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.

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