SCHEMBL8000759

SCHEMBL8000759

CCc1cc2c(s1)CCCC2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.56
ADRA1D P25100 2/20 0.49
ALDH1A1 P00352 7/20 0.44
PKM P14618 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
GAA P10253 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
ADRA2A P08913 3/20 0.42
ADRA2B P18089 3/20 0.42
ADRA2C P18825 3/20 0.42
HPGD P15428 4/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
DAO P14920 1/20 0.40

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
SCHEMBL11987816 0.98 POLB (0.59) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL11987826 0.98 POLB (0.59) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL10158642 0.96 POLB (0.51) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL16519854 0.84 POLB (0.53) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL11237572 0.79 POLB (0.61) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL16423060 0.79 POLB (0.56) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL16673447 0.79 POLB (0.51) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL21027500 0.79 POLB (0.51) POLBADRA1DALDH1A1PKMMEN1
SCHEMBL22895103 0.77 POLB (0.37) POLBADRA1DALDH1A1MEN1GAA
SCHEMBL3551196 0.75 POLB (0.56) POLBADRA1DALDH1A1PKMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11586060-B2 Optical filter with light source SOLUTIA CANADA INC. (CA) 2023-02-21 US disclosed
US-9910301-B2 Switchable optical filter apparatus with light SWITCH MATERIALS, INC. (CA) 2018-03-06 US disclosed
EP-2580207-B1 NITROGEN CONTAINING HETEROARYL COMPOUNDS HOFFMANN LA ROCHE (CH) 2017-09-27 EP disclosed
US-20160318935-A1 BIARYL BRUTON'S TYROSINE KINASE INHIBITORS BIOGEN MA INC. 2016-11-03 US disclosed
US-9290440-B2 Bicyclic compound TOA EIYO LTD. (JP) 2016-03-22 US disclosed
US-20150119418-A1 BICYCLIC COMPOUND TOA EIYO LTD. (JP) 2015-04-30 US disclosed
WO-2013123592-A1 OPTICAL FILTER WITH LIGHT SOURCE SWITCH MATERIALS INC. (CA) 2013-08-29 WO disclosed
US-8247550-B2 Certain substituted amides, method of making, and method of use thereof GILEAD CONNECTICUT, INC. (US) 2012-08-21 US disclosed
US-20120209005-A1 FUSED HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-08-16 US disclosed
US-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF Gilead Connecticut INc. (US) 2011-12-08 US disclosed
US-20110282064-A1 METHOD FOR THE MANUFACTURE OF HIGHLY PURE PRASUGREL ZENTIVA K.S. (CZ) 2011-11-17 US disclosed
US-20110059944-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof GILEAD CONNECTICUT, INC. 2011-03-10 US disclosed
US-7884108-B2 tyrosine kinase inhibitors such as N-(3-(6-(4-(1,4-Dimethyl-3-oxopiperazin-2-yl)phenyl amino)-4-methyl-5-oxo-4,5-dihydropyrazin-2-yl)-2-fluorophenyl)-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxamide for treating bone disorders, allergic disorders, autoimmune diseases, inflammatory diseases CGI PHARMACEUTICALS, INC. (US) 2011-02-08 US disclosed
WO-2009119088-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 WO disclosed
US-20090082330-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF GILEAD CONNECTICUT, INC. 2009-03-26 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 (7 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-20110301145-A1 PYRIDAZINONES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, LCK POLB 2133/4885ADRA1D 2610/4885ALDH1A1 3488/4885
US-20120209005-A1 FUSED HETEROCYCLIC COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS MPL, TEK, THPO POLB 4165/4885ADRA1D 739/4885ALDH1A1 2398/4885
US-20110059944-A1 Certain Substituted Amides, Method of Making, and Method of Use Thereof BTK, SYK, MYD88 POLB 2798/4885ADRA1D 3284/4885ALDH1A1 3393/4885
US-20110282064-A1 METHOD FOR THE MANUFACTURE OF HIGHLY PURE PRASUGREL P2RY6, GP6, CYP2B6 POLB 4066/4885ADRA1D 1622/4885ALDH1A1 687/4885
US-20160318935-A1 BIARYL BRUTON'S TYROSINE KINASE INHIBITORS ABL1, BTK, LYN POLB 1877/4885ADRA1D 4134/4885ALDH1A1 4256/4885
US-20090082330-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF BTK, SYK, MYD88 POLB 2798/4885ADRA1D 3284/4885ALDH1A1 3393/4885
US-20150119418-A1 BICYCLIC COMPOUND C1S, C1R, CYP11B2 POLB 2833/4885ADRA1D 680/4885ALDH1A1 2350/4885

“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.