SCHEMBL3313637

SCHEMBL3313637

NCc1ncnc2[nH]cnc12

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.34
HRH1 P35367 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
DPP4 P27487 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
PI4KA P42356 2/20 0.31
PI4K2B Q8TCG2 2/20 0.31
PI4K2A Q9BTU6 2/20 0.31
PI4KB Q9UBF8 2/20 0.31
LMNA P02545 1/20 0.31
DRD3 P35462 1/20 0.31
XDH P47989 1/20 0.31
LRRK2 Q5S007 1/20 0.31
AKT2 P31751 1/20 0.30
DPP8 Q6V1X1 1/20 0.30

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
SCHEMBL11903082 0.82 CYP3A4 (0.34) PI4KAPI4K2BPI4K2API4KBLMNA
SCHEMBL15597610 0.82 CSNK2A2 (0.32) PI4KAPI4K2BPI4K2API4KBLMNA
SCHEMBL129625 0.82 HTT (0.34) HRH2HRH1HRH4HRH3TDP1
SCHEMBL5019516 0.79 PRKACA (0.38) HRH2HRH1HRH4HRH3TDP1
SCHEMBL24292894 0.77 CHRM4 (0.35) HRH2HRH1HRH4HRH3TDP1
SCHEMBL532652 0.77 HIF1A (0.33)
SCHEMBL15354464 0.77 KDM4A (0.50) HRH2HRH1HRH4HRH3TDP1
SCHEMBL7073447 0.76 HRH3 (0.41) HRH2HRH1HRH4HRH3TDP1
SCHEMBL5019517 0.76 KDM4A (0.34) HRH2HRH1HRH4HRH3
SCHEMBL4419597 0.74 PAK1 (0.41) HRH4HRH3PI4KAPI4K2BPI4K2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513928-B1 A BANK OF STEM CELLS FOR PRODUCING CELLS FOR TRANSPLANTATION HAVING HLA ANTIGENS MATCHING THOSE OF TRANSPLANT RECIPIENTS, AND METHODS FOR MAKING AND USING SUCH A STEM CELL BANK ADVANCED CELL TECH INC (US) 2019-08-21 EP disclosed
US-20190225937-A1 BANK OF STEM CELLS FOR PRODUCING CELLS FOR TRANSPLANTATION HAVING HLA ANTIGENS MATCHING THOSE OF TRANSPLANT RECIPIENTS AND METHODS FOR MAKING AND USING SUCH A STEM CELL BANK ADVANCED CELL TECH INC (US) 2019-07-25 US disclosed
US-20130276154-A1 Bank of stem cells for producing cells for transplantation having HLA antigens matching those of transplant recipients, and methods for making and using such a stem cell bank ADVANCED CELL TECHNOLOGY, INC. 2013-10-17 US disclosed
US-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 US disclosed
US-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-04-29 US disclosed
WO-2008100447-A2 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2008-08-21 WO disclosed
EP-1513928-A2 A BANK OF STEM CELLS FOR PRODUCING CELLS FOR TRANSPLANTATION HAVING HLA ANTIGENS MATCHING THOSE OF TRANSPLANT RECIPIENTS, AND METHODS FOR MAKING AND USING SUCH A STEM CELL BANK Advanced Cell Technology, Inc. (US) 2005-03-16 EP disclosed
US-20040091936-A1 Bank of stem cells for producing cells for transplantation having HLA antigens matching those of transplant recipients, and methods for making and using such a stem cell bank ADVANCED CELL TECHNOLOGY, INC. 2004-05-13 US disclosed
WO-2003100018-A2 A BANK OF STEM CELLS FOR TRANSPLANTATION ADVANCED CELL TECHNOLOGY, INC. (US) 2003-12-04 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 (1 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-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT SLC29A1, NUDT1, EIF2AK2 HRH2 4628/4885HRH1 4012/4885HRH4 4124/4885

“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.