SCHEMBL1506801

SCHEMBL1506801

C=C(C)C(N)=O.CCCN(Cc1ccccc1B(O)O)Cc1c2ccccc2cc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
ERN1 O75460 2/20 0.32
HTR2A P28223 1/20 0.31
TSHR P16473 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MOK Q9UQ07 1/20 0.31
HTR1A P08908 1/20 0.30
MEN1 O00255 1/20 0.30
CDYL Q9Y232 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
SCHEMBL17013844 0.89 ALDH1A1 (0.47) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL1506800 0.82 APP (0.35) ALDH1A1TSHRLMNASMN1; SMN2
SCHEMBL17013838 0.80 CYP1A2 (0.48) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL6834459 0.77 LIPG (0.37) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9
SCHEMBL17013843 0.75 CYP2D6 (0.50) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C19
SCHEMBL1506799 0.73 KMT2A (0.30) KMT2A
SCHEMBL15586613 0.73 NQO2 (0.44)
SCHEMBL7269820 0.73 APP (0.35) ALDH1A1TSHRLIPGSMN1; SMN2
SCHEMBL4460221 0.72 CYP2D6 (0.50) KMT2ACYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL20926054 0.71 MAPT (0.36) ALDH1A1KMT2ACYP1A2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2292626-B1 Detection of analytes in aqueous environments SENSEONICS INC (US) 2014-05-21 EP claimed
EP-1557422-B1 Detection of analytes in aqueous environments SENSEONICS INC (US) 2013-12-25 EP claimed
EP-1307464-B1 DETECTION OF ANALYTES IN AQUEOUS ENVIRONMENTS SENSEONICS INC (US) 2013-02-13 EP claimed
US-7939332-B2 Detection of analytes in aqueous environments SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2011-05-10 US claimed
EP-2292626-A1 Detection of analytes in aqueous environments Sensors for Medicine and Science, Inc. (US) 2011-03-09 EP claimed
WO-2007011691-A2 IMPLANTABLE DEVICE FOR DETECTING AN ANALYTE IN VIVO SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2007-01-25 WO claimed
US-20070014726-A1 Oxidation-resistant indicator macromolecule SENSORS FOR MEDICINE AND SCIENCE (US) 2007-01-18 US claimed
US-20060281185-A1 Detection of analytes in aqueous environments SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2006-12-14 US claimed
US-7060503-B2 Detection of Analytes in aqueous environments SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2006-06-13 US claimed
EP-1557422-A2 Detection of analytes in aqueous environments Sensors for Medicine and Science, Inc. (US) 2005-07-27 EP claimed
US-20040229370-A1 Detection of analytes in aqueous environments SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2004-11-18 US claimed
US-6794195-B2 QUANTITATIVE, QUALITATIVE ANALYSIS SENSORS FOR MEDICINE & SCIENCE, INC. 2004-09-21 US claimed
US-6711423-B2 Optical-based sensing devices SENSORS FOR MEDICINE AND SCIENCE, INC. 2004-03-23 US claimed
EP-1307464-A1 DETECTION OF ANALYTES IN AQUEOUS ENVIRONMENTS Sensors for Medicine and Science, Inc. (US) 2003-05-07 EP claimed
US-20020039793-A1 Detection of analytes in aqueous environments SENSORS FOR MEDICINE AND SCIENCE, INC. 2002-04-04 US claimed
US-20020026108-A1 Optical-based sensing devices SENSEONICS, INCORPORATED 2002-02-28 US claimed
WO-2002012251-A1 DETECTION OF ANALYTES IN AQUEOUS ENVIRONMENTS SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2002-02-14 WO claimed
EP-2292626-B1 Detection of analytes in aqueous environments SENSEONICS INC (US) 2014-05-21 EP disclosed
US-20020039793-A1 Detection of analytes in aqueous environments SENSORS FOR MEDICINE AND SCIENCE, INC. 2002-04-04 US disclosed
US-20020026108-A1 Optical-based sensing devices SENSEONICS, INCORPORATED 2002-02-28 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 (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-20070014726-A1 Oxidation-resistant indicator macromolecule MB, LPO, GPX4 ALDH1A1 112/4885KMT2A 4038/4885CYP1A2 452/4885
US-20060281185-A1 Detection of analytes in aqueous environments MPI, NEFM, CD44 ALDH1A1 2329/4885KMT2A 4837/4885CYP1A2 2266/4885

“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.