SCHEMBL65833

SCHEMBL65833

CCCCCC[CH]C1CCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.41
TSHR P16473 2/20 0.39
NAAA Q02083 2/20 0.38
SIGMAR1 Q99720 2/20 0.37
EPHX1 P07099 5/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL892025 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL22042665 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL8770230 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL6715525 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL22042671 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL22042602 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL6263591 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL6716866 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL891828 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1
SCHEMBL8769510 1.00 CYP1A2 (0.41) CYP1A2TSHRNAAASIGMAR1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2288340-B1 NANOPARTICLE FORMULATIONS AND USES THEREOF ABRAXIS BIOSCIENCE LLC (US) 2020-06-24 EP disclosed
EP-2416650-B1 NANOPARTICLE FORMULATIONS AND USES THEROF ABRAXIS BIOSCIENCE LLC (US) 2020-02-26 EP disclosed
US-10570431-B2 Compositions comprising a polypeptide having cellulolytic enhancing activity and a heterocyclic compound and uses thereof NOVOZYMES, INC. (US) 2020-02-25 US disclosed
US-20180363018-A1 Compositions Comprising A Polypeptide Having Cellulolytic Enhancing Activity And A Heterocyclic Compound And Uses Thereof NOVOZYMES, INC. (US) 2018-12-20 US disclosed
US-20180289620-A1 NANOPARTICLE FORMULATIONS AND USES THEREOF ABRAXIS BIOSCIENCE, LLC 2018-10-11 US disclosed
US-10087478-B2 Compositions comprising a polypeptide having cellulolytic enhancing activity and a nitrogen-containing compound and uses thereof NOVOZYMES, INC. (US) 2018-10-02 US disclosed
US-10041101-B2 Compositions comprising a polypeptide having cellulolytic enhancing activity and a heterocyclic compound and uses thereof NOVOZYMES, INC. (US) 2018-08-07 US disclosed
EP-2603594-B1 COMPOSITIONS COMPRISING A POLYPEPTIDE HAVING CELLULOLYTIC ENHANCING ACTIVITY AND A BICYCLIC COMPOUND AND USES THEREOF NOVOZYMES INC (US) 2018-04-25 EP disclosed
EP-2603598-B1 COMPOSITIONS COMPRISING A GH61 POLYPEPTIDE HAVING CELLULOLYTIC ENHANCING ACTIVITY AND A QUINONE COMPOUND AND USES THEREOF NOVOZYMES INC (US) 2018-04-18 EP disclosed
US-20180019412-A1 Compositions Comprising A Polypeptide Having Cellulolytic Enhancing Activity And A Quinone Compound And Uses Thereof NOVOZYMES, INC. (US) 2018-01-18 US disclosed
EP-2170913-A1 PLATINUM (IV) COMPLEXES Platco Technologies (Proprietary) Limited (ZA) 2010-04-07 EP disclosed
WO-2010014943-A2 METHIONINE ANALOGS AND METHODS OF USING SAME BIOXINESS PHARMACEUTICS, INC. (US) 2010-02-04 WO disclosed
US-20100003246-A1 Novel heterocyclic compounds and uses therof NOVARTIS AG (CH) 2010-01-07 US disclosed
US-20090263483-A1 NANOPARTICLE FORMULATIONS AND USES THEREOF ABRAXIS BIOSCIENCE, LLC 2009-10-22 US disclosed
WO-2009126401-A1 COMPOSITIONS OF HYDROPHOBIC TAXANE DERIVATIVES AND USES THEREOF ABRAXIS BIOSCIENCE, LLC (US) 2009-10-15 WO disclosed
WO-2009126175-A1 COMPOSITIONS OF HYDROPHOBIC TAXANE DERIVATIVES AND USES THEREOF ABRAXIS BIOSCIENCE, LLC (US) 2009-10-15 WO disclosed
WO-2009126938-A1 NANOPARTICLE FORMULATIONS AND USES THEREOF ABRAXIS BIOSCIENCES, LLC (US) 2009-10-15 WO disclosed
WO-2009115572-A2 NOVEL HETEROCYCLIC COMPOUNDS AND USES THEROF NOVARTIS AG (CH) 2009-09-24 WO disclosed
WO-2009042694-A1 (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING COMENTIS, INC. (US) 2009-04-02 WO disclosed
WO-2008155727-A1 PLATINUM (IV) COMPLEXES PLATCO TECHNOLOGIES (PROPRIETARY) LIMITED (ZA) 2008-12-24 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 (6 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-20180019412-A1 Compositions Comprising A Polypeptide Having Cellulolytic Enhancing Activity And A Quinone Compound And Uses Thereof PGLS, CEL, PNLIP CYP1A2 2285/4885TSHR 4714/4885NAAA 182/4885
US-20090263483-A1 NANOPARTICLE FORMULATIONS AND USES THEREOF ABCB1, SLC47A1, ABCC1 CYP1A2 3547/4885TSHR 4298/4885NAAA 4161/4885
US-20180289620-A1 NANOPARTICLE FORMULATIONS AND USES THEREOF ABCB1, SLC47A1, ABCC1 CYP1A2 3547/4885TSHR 4298/4885NAAA 4161/4885
US-10570431-B2 Compositions comprising a polypeptide having cellulolytic enhancing activity and a heterocyclic compound and uses thereof CEL, VIP, CTRC CYP1A2 1933/4885TSHR 3944/4885NAAA 136/4885
US-20180363018-A1 Compositions Comprising A Polypeptide Having Cellulolytic Enhancing Activity And A Heterocyclic Compound And Uses Thereof CEL, VIP, CTRC CYP1A2 1933/4885TSHR 3944/4885NAAA 136/4885
US-20100003246-A1 Novel heterocyclic compounds and uses therof BRAF, ARAF, KRAS CYP1A2 4611/4885TSHR 3286/4885NAAA 2908/4885

“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.