SCHEMBL1531429

SCHEMBL1531429

O=[N+]([O-])c1ccccc1C=CBr

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.62
SOS1 Q07889 1/20 0.59
MAOB P27338 1/20 0.57
ALDH1A1 P00352 4/20 0.55
LMNA P02545 2/20 0.55
ATM Q13315 2/20 0.55
HSP90AA1 P07900 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
RAB9A P51151 4/20 0.53
NPC1 O15118 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
CYP19A1 P11511 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
BACE1 P56817 1/20 0.50
CA12 O43570 1/20 0.50

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
SCHEMBL1531427 1.00 MAPT (0.62) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL11049170 0.89 MAPT (0.69) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL14935499 0.89 MAPT (0.69) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL9978289 0.89 MAPT (0.69) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL11296000 0.87 MAPT (0.67) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL11299049 0.87 MAPT (0.67) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL5440780 0.85 SOS1 (0.71) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL2550458 0.85 MAPT (0.55) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL5440784 0.85 SOS1 (0.71) MAPTSOS1MAOBALDH1A1LMNA
SCHEMBL1578978 0.82 MAPT (0.66) MAPTSOS1MAOBALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10597314-B2 Fatty acid biodispersant and methods of use GENERAL ELECTRIC COMPANY (US) 2020-03-24 US claimed
EP-2173670-B1 METHOD FOR CONTROLLING MICROBIAL BIOFILM IN AQUEOUS SYSTEMS GEN ELECTRIC (US) 2017-08-16 EP claimed
US-20160280570-A1 FATTY ACID BIODISPERSANT AND METHODS OF USE BL TECHNOLOGIES, INC. 2016-09-29 US claimed
EP-3071524-A1 FATTY ACID BIODISPERSANT AND METHODS OF USE General Electric Company (US) 2016-09-28 EP claimed
US-8784659-B2 Method for controlling microbial biofilm in aqueous systems GENERAL ELECTRIC COMPANY (US) 2014-07-22 US claimed
WO-2012021006-A3 DOUBLE-LAYER METAL THIN FILM TYPE ELECTRIC POWER GENERATOR, AND INTEGRATED ELECTRIC POWER GENERATOR USING SAME CHUN SUN JU (KR) 2012-05-10 WO claimed
US-7935521-B2 Methods and compositions for rapidly detecting and quantifying viable Legionella PHIGENICS, LLC (US) 2011-05-03 US claimed
US-20110052656-A1 METHOD FOR CONTROLLING MICROBIAL BIOFILM IN AQUEOUS SYSTEMS GENERAL ELECTRIC COMPANY (US) 2011-03-03 US claimed
US-20110052655-A1 METHODS AND VESICLES FOR CONTROLLING PROTOZOA GENERAL ELECTRIC COMPANY 2011-03-03 US claimed
US-7824557-B2 Method for controlling microbial biofilm in aqueous systems GENERAL ELECTRIC COMPANY (US) 2010-11-02 US claimed
EP-2173670-A1 METHOD FOR CONTROLLING MICROBIAL BIOFILM IN AQUEOUS SYSTEMS General Electric Company (US) 2010-04-14 EP claimed
WO-2009020694-A1 METHOD FOR CONTROLLING MICROBIAL BIOFILM IN AQUEOUS SYSTEMS GENERAL ELECTRIC COMPANY (US) 2009-02-12 WO claimed
US-20090039035-A1 METHOD FOR CONTROLLING MICROBIAL BIOFLIM IN AQUEOUS SYSTEMS BL TECHNOLOGIES, INC. 2009-02-12 US claimed
US-20070218522-A1 METHODS AND COMPOSITIONS FOR RAPIDLY DETECTING AND QUANTIFYING VIABLE LEGIONELLA PHIGENICS LLC (US) 2007-09-20 US claimed
US-20060211082-A1 Methods and compositions for rapidly detecting and quantifying viable Legionella PHIGENICS, LLC 2006-09-21 US claimed
US-6585933-B1 Method and composition for inhibiting corrosion in aqueous systems BETZDEARBORN, INC. 2003-07-01 US claimed
EP-1177331-A1 METHOD AND COMPOSITION FOR INHIBITING CORROSION IN AQUEOUS SYSTEMS BetzDearborn Inc (US) 2002-02-06 EP claimed
WO-2000066810-A1 METHOD AND COMPOSITION FOR INHIBITING CORROSION IN AQUEOUS SYSTEMS BETZDEARBORN INC. (US) 2000-11-09 WO claimed
US-10597314-B2 Fatty acid biodispersant and methods of use GENERAL ELECTRIC COMPANY (US) 2020-03-24 US disclosed
WO-2000066810-A1 METHOD AND COMPOSITION FOR INHIBITING CORROSION IN AQUEOUS SYSTEMS BETZDEARBORN INC. (US) 2000-11-09 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-20110052655-A1 METHODS AND VESICLES FOR CONTROLLING PROTOZOA CTRL, LIPA, EXOSC9 MAPT 4289/4885SOS1 3055/4885MAOB 3621/4885
US-20110052656-A1 METHOD FOR CONTROLLING MICROBIAL BIOFILM IN AQUEOUS SYSTEMS PGLS, PLTP, PHOSPHO1 MAPT 3037/4885SOS1 1793/4885MAOB 1879/4885

“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.