SCHEMBL1104590

SCHEMBL1104590

CC(C)n1cc2c(=O)c3ccccc3[nH]c2nc1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
GAA P10253 3/20 0.46
KDM4E B2RXH2 3/20 0.46
HTT P42858 3/20 0.46
GLA P06280 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 2/20 0.46
ATM Q13315 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
HAVCR2 Q8TDQ0 1/20 0.39
CA5A P35218 1/20 0.38
IMPDH2 P12268 2/20 0.38
ABCB1 P08183 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
MAOA P21397 1/20 0.37

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
SCHEMBL1104588 0.92 ALDH1A1 (0.43) ALDH1A1GAAKDM4EHTTGLA
SCHEMBL14183841 0.76 AURKA (0.46) ALDH1A1KDM4EHTTSMN1; SMN2POLB
SCHEMBL18080585 0.75
SCHEMBL18080581 0.74
SCHEMBL18080580 0.73
SCHEMBL18080586 0.73
SCHEMBL13395617 0.72 CA5A (0.50) ALDH1A1GAAKDM4EHTTGLA
SCHEMBL18080609 0.72 LCK (0.30) KDM4EKMT2A
SCHEMBL18080431 0.71 KDM4E (0.39) ALDH1A1GAAKDM4EHTTGLA
SCHEMBL18080432 0.71 JAK1 (0.38) ALDH1A1GAAKDM4EGLALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541599-B2 Supports for oligomer synthesis ISIS PHARMACEUTICALS, INC. (US) 2013-09-24 US disclosed
US-20120165547-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ISIS PHARMACEUTICALS, INC. (US) 2012-06-28 US disclosed
US-8153725-B2 Supports for oligomer synthesis ISIS PHARMACEUTICALS, INC (US) 2012-04-10 US disclosed
US-7939677-B2 Oligomeric compounds comprising 4′-thionucleosides for use in gene modulation ISIS PHARMACEUTICALS, INC. (US) 2011-05-10 US disclosed
US-7875733-B2 Nucleosides; RNA interference; gene expression inhibition; for use in therapeutic, diagnostic, and research applications involving gene silencing ISIS PHARMACEUTICALS, INC. (US) 2011-01-25 US disclosed
US-20100324277-A1 OLIGOMERIC COMPOUNDS COMPRISING 4'-THIONUCLEOSIDES FOR USE IN GENE MODULATION ISIS PHARMACEUTICALS, INC. (US) 2010-12-23 US disclosed
US-20100234528-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ISIS PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-7718810-B2 Supports such as glass and styrene polymers functionalized with tricyclic hetercyclic anhydrides and imides, used in the preparation of oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 2010-05-18 US disclosed
US-7713944-B2 Oligomers comprising activated disulfides which bind to plasma proteins and their use for delivery to cells ISIS PHARMACEUTICALS, INC. (US) 2010-05-11 US disclosed
US-7700706-B2 Polymeric beads for oligomer synthesis ISIS PHARMACEUTICALS, INC. (US) 2010-04-20 US disclosed
US-7576119-B2 Supports for oligomer synthesis ISIS PHARMACEUTICALS, INC. (US) 2009-08-18 US disclosed
US-20090131682-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ISIS PHARMACEUTICALS, INC. (US) 2009-05-21 US disclosed
US-7427675-B2 Compounds and methods for the characterization of oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 2008-09-23 US disclosed
US-20080119645-A1 Immobilization; solid phase synthesis ISIS PHARMACEUTICALS, INC. (US) 2008-05-22 US disclosed
US-20080097028-A1 POLYMERIC BEADS FOR OLIGOMER SYNTHESIS LSIS PHARMACEUTICALS, INC. (US) 2008-04-24 US disclosed
US-7348391-B2 Polymeric beads for oligomer synthesis ISIS PHARMACEUTICALS, INC. (US) 2008-03-25 US disclosed
US-20080021224-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ISIS PHARMACEUTICALS, INC. (US) 2008-01-24 US disclosed
US-7276599-B2 Oligonucleotide synthesis with alternative solvents ISIS PHARMACEUTICALS, INC. (US) 2007-10-02 US disclosed
US-7202264-B2 Supports such as glass and styrene polymers functionalized with tricyclic hetercyclic anhydrides and imides, used in the preparation of oligonucleotides ISIS PHARMACEUTICALS, INC. (US) 2007-04-10 US disclosed
US-7169916-B2 Chloral-free DCA in oligonucleotide synthesis ISIS PHARMACEUTICALS, INC. (US) 2007-01-30 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-20090131682-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ILK, NOP2, PFAS ALDH1A1 4121/4885GAA 2060/4885KDM4E 3557/4885
US-20080097028-A1 POLYMERIC BEADS FOR OLIGOMER SYNTHESIS NEFM, NOD2, MACF1 ALDH1A1 4011/4885GAA 4678/4885KDM4E 3485/4885
US-20120165547-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ILK, NOP2, PFAS ALDH1A1 4121/4885GAA 2060/4885KDM4E 3557/4885
US-20080021224-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ILK, NOP2, PFAS ALDH1A1 4121/4885GAA 2060/4885KDM4E 3557/4885
US-20080119645-A1 Immobilization; solid phase synthesis RNGTT, NOP2, NSUN2 ALDH1A1 2734/4885GAA 2001/4885KDM4E 2406/4885
US-20100324277-A1 OLIGOMERIC COMPOUNDS COMPRISING 4'-THIONUCLEOSIDES FOR USE IN GENE MODULATION SNRPE, NSUN3, NSUN2 ALDH1A1 4066/4885GAA 2918/4885KDM4E 3503/4885
US-20100234528-A1 SUPPORTS FOR OLIGOMER SYNTHESIS ILK, NOP2, PFAS ALDH1A1 4121/4885GAA 2060/4885KDM4E 3557/4885

“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.