SCHEMBL517635

SCHEMBL517635

C1=Cc2ccccc2NCc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
PARP1 P09874 1/20 0.50
NPSR1 Q6W5P4 1/20 0.47
HSD17B3 P37058 1/20 0.41
HTR5A P47898 2/20 0.40
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
AHR P35869 1/20 0.33
PDK2 Q15119 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
HSP90AA1 P07900 1/20 0.33
THRB P10828 1/20 0.33
HK1 P19367 1/20 0.33

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
SCHEMBL29749158 1.00 ALOX15 (0.52) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL517634 1.00 ALOX15 (0.52) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL17667590 0.80 GAA (0.39) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL17667588 0.80 GAA (0.39) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL17667600 0.80 GAA (0.39) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL4046186 0.80 TRPA1 (0.40) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL17667601 0.80 GAA (0.39) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL4046182 0.80 TRPA1 (0.40) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL20777448 0.79 GAA (0.46) ALOX15HSD17B10GAAMAPTPARP1
SCHEMBL6137103 0.77 MAPT (0.48) ALOX15HSD17B10GAAMAPTPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11242359-B2 Biocompatible modular tetrazine platform CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-02-08 US claimed
US-20200354381-A1 BIOCOMPATIBLE MODULAR TETRAZINE PLATFORM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-11-12 US claimed
EP-3609885-A1 BIOCOMPATIBLE MODULAR TETRAZINE PLATFORM Centre National De La Recherche Scientifique (FR) 2020-02-19 EP claimed
WO-2018172543-A1 BIOCOMPATIBLE MODULAR TETRAZINE PLATFORM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-09-27 WO claimed
EP-3903826-B1 BIOMOLECULE CONJUGATES CELGENE CORP (US) 2024-05-08 EP disclosed
EP-4289483-A2 BIOMOLECULE CONJUGATES Celgene Corporation (US) 2023-12-13 EP disclosed
US-11242359-B2 Biocompatible modular tetrazine platform CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2022-02-08 US disclosed
EP-3903826-A1 BIOMOLECULE CONJUGATES Celgene Corporation (US) 2021-11-03 EP disclosed
US-20200354381-A1 BIOCOMPATIBLE MODULAR TETRAZINE PLATFORM CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-11-12 US disclosed
EP-3609885-A1 BIOCOMPATIBLE MODULAR TETRAZINE PLATFORM Centre National De La Recherche Scientifique (FR) 2020-02-19 EP disclosed
US-RE47539-E1 Aza-dibenzocyclooctynes and methods of making and using same UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2019-07-30 US disclosed
US-10335495-B2 Biomolecule conjugates CELGENE CORPORATION (US) 2019-07-02 US disclosed
WO-2016090157-A1 BIOMOLECULE CONJUGATES CELGENE CORPORATION (US) 2016-06-09 WO disclosed
US-8912322-B2 Aza-dibenzocyclooctynes and methods of making and using same UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2014-12-16 US disclosed
US-20120197012-A9 AZA-DIBENZOCYCLOOCTYNES AND METHODS OF MAKING AND USING SAME UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2012-08-02 US disclosed
US-20120029186-A1 AZA-DIBENZOCYCLOOCTYNES AND METHODS OF MAKING AND USING SAME UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2012-02-02 US disclosed
US-8039474-B2 2,3,4,9-tetrahydro-1H-carbazole derivatives as CRTH2 receptor antagonists ACTELION PHARMACEUTICAL LTD. (CH) 2011-10-18 US disclosed
US-7897788-B2 Indol-1-yl-acetic acid derivatives ACTELION PHARMACEUTICAL LTD. (CH) 2011-03-01 US disclosed
EP-1740171-B1 INDOL-1-YL-ACETIC ACID DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2010-06-09 EP disclosed
US-20070208004-A1 Indol-1-yl-acetic acid derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2007-09-06 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 (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-10335495-B2 Biomolecule conjugates DNPEP, NAPA, NCL ALOX15 2575/4885HSD17B10 2325/4885GAA 438/4885
US-20200354381-A1 BIOCOMPATIBLE MODULAR TETRAZINE PLATFORM DYRK4, TALDO1, DYRK3 ALOX15 1212/4885HSD17B10 1833/4885GAA 1807/4885
US-20070208004-A1 Indol-1-yl-acetic acid derivatives IDO1, IDO2, AANAT ALOX15 1439/4885HSD17B10 620/4885GAA 239/4885
US-20120197012-A9 AZA-DIBENZOCYCLOOCTYNES AND METHODS OF MAKING AND USING SAME AZI2, AOC1, DDT ALOX15 643/4885HSD17B10 995/4885GAA 1770/4885
US-20120029186-A1 AZA-DIBENZOCYCLOOCTYNES AND METHODS OF MAKING AND USING SAME AZI2, AOC1, DDT ALOX15 643/4885HSD17B10 995/4885GAA 1770/4885
US-11242359-B2 Biocompatible modular tetrazine platform DYRK4, TALDO1, DYRK3 ALOX15 1212/4885HSD17B10 1833/4885GAA 1807/4885

“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.