SCHEMBL2383960

SCHEMBL2383960

O=C(Cc1ccccc1O)Nc1ncnc2[nH]cnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.40
AKR1B1 P15121 1/20 0.40
CCNB2 O95067 2/20 0.39
CDK1 P06493 2/20 0.39
CCNB1 P14635 2/20 0.39
CCNB3 Q8WWL7 2/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.37
BRD4 O60885 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ANO1 Q5XXA6 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL2623137 0.83 NAMPT (0.50) KMT2AMEN1NPC1RAB9ABRD4
SCHEMBL786293 0.82 CCNB2 (0.56) CCNB2CDK1CCNB1CCNB3KMT2A
SCHEMBL1369225 0.77 XDH (0.41) BRD4CYP2D6CYP2C19LMNA
SCHEMBL6933552 0.76 ALPL (0.52) NPC1RAB9AMAPTALDH1A1LMNA
Hydrochloric Acid SCHEMBL1371823 0.76 XDH (0.40) BRD4CYP2D6CYP2C19LMNA
SCHEMBL17778780 0.76 XDH (0.42) NPC1RAB9AMAPTBRD4CYP1A2
SCHEMBL16147217 0.75 CCNB2 (0.46) CCNB2CDK1CCNB1CCNB3KMT2A
SCHEMBL1372970 0.75 AURKA (0.45) BRD4CYP1A2CYP2D6CYP2C9ALDH1A1
Hydrochloric Acid SCHEMBL1370666 0.74 AURKA (0.44) CYP1A2CYP2D6CYP2C9ALDH1A1LMNA
SCHEMBL23123 0.73 BRD4 (0.64) NPC1RAB9APOLBBRD4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680262-B2 Purification of oligonucleotides GIRINDUS AG (DE) 2014-03-25 US disclosed
US-20130066061-A1 PURIFICATION OF OLIGONUCLEOTIDES GIRINDUS AG (DE) 2013-03-14 US disclosed
US-8304532-B2 Method for preparing oligonucleotides GIRINDUS AG (DE) 2012-11-06 US disclosed
EP-1525212-B1 METHOD FOR PREPARING OLIGONUCLEOTIDES GIRINDUS AG (DE) 2012-09-12 EP disclosed
US-20110224424-A1 Method for preparing oligonucleotides GIRINDUS AG (DE) 2011-09-15 US disclosed
US-20100087635-A1 PURIFICATION OF OLIGONUCLEOTIDES GIRINDUS AG (DE) 2010-04-08 US disclosed
US-20100069623-A1 Method for preparing oligonucleotides GIRINDUS AG (DE) 2010-03-18 US disclosed
EP-1846431-A1 PURIFICATION OF OLIGONUCLEOTIDES Girindus AG (DE) 2007-10-24 EP disclosed
WO-2006079660-A1 PURIFICATION OF OLIGONUCLEOTIDES GIRINDUS AG (DE) 2006-08-03 WO disclosed
US-20060089494-A1 Method for preparing oligonucleotides GIRINDUS AG (DE) 2006-04-27 US disclosed
EP-1525212-A1 METHOD FOR PREPARING OLIGONUCLEOTIDES Girindus AG (DE) 2005-04-27 EP disclosed
WO-2004013154-A1 METHOD FOR PREPARING OLIGONUCLEOTIDES GIRINDUS AG (DE) 2004-02-12 WO disclosed
EP-1386925-A1 Method for preparing oligonucleotides Girindus AG (DE) 2004-02-04 EP 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 (3 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-20100069623-A1 Method for preparing oligonucleotides RNGTT, NSUN2, RNMT ROCK1 4744/4885AKR1B1 3587/4885CCNB2 1489/4885
US-20110224424-A1 Method for preparing oligonucleotides RNGTT, NSUN2, RNMT ROCK1 4744/4885AKR1B1 3587/4885CCNB2 1489/4885
US-20060089494-A1 Method for preparing oligonucleotides RNGTT, NSUN2, RNMT ROCK1 4654/4885AKR1B1 682/4885CCNB2 701/4885

“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.