SCHEMBL2395594

SCHEMBL2395594

CSc1ncnc2cscc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 2/20 0.34
HTT P42858 2/20 0.34
NCOA1 Q15788 2/20 0.34
NCOA3 Q9Y6Q9 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FLT3 P36888 2/20 0.32
RAB9A P51151 1/20 0.32
KDR P35968 1/20 0.31
KDM1A O60341 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
SCHEMBL13841393 0.72 IRAK4 (0.41) IRAK4ALDH1A1KDM4EHTTNCOA1
SCHEMBL19160402 0.72 KMT2A (0.37) IRAK4ALDH1A1LMNAHSD17B10KDM4E
SCHEMBL9202302 0.67 KDR (0.38) IRAK4ALDH1A1LMNATP53HSD17B10
SCHEMBL6833209 0.65 EGFR (0.42) ALDH1A1LMNATP53HSD17B10HTT
SCHEMBL6837647 0.65 EGFR (0.42) RAB9A
SCHEMBL6836416 0.64 EGFR (0.46)
SCHEMBL3528078 0.64 EGFR (0.47) LMNAHTTRAB9AKDR
SCHEMBL10548235 0.64 NR4A2 (0.43) ALDH1A1LMNAKDM4EHTTHPGD
SCHEMBL2395940 0.64 ALDH1A1 (0.34) ALDH1A1LMNATP53HSD17B10HTT
SCHEMBL6837677 0.63 ALDH1A1 (0.43) ALDH1A1LMNATP53HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2719701-B1 Method for the preparation of thieno[3,4-d]pyrimidin-7-yl ribosides GILEAD SCIENCES INC (US) 2017-04-05 EP disclosed
EP-2719701-B1 Method for the preparation of thieno[3,4-d]pyrimidin-7-yl ribosides GILEAD SCIENCES INC (US) 2017-04-05 EP disclosed
EP-2719701-A1 methods for the preparation of thieno[3,4-d]pyrimidin-7-yl ribosides GILEAD SCIENCES, INC. (US) 2014-04-16 EP disclosed
EP-2719701-A1 methods for the preparation of thieno[3,4-d]pyrimidin-7-yl ribosides GILEAD SCIENCES, INC. (US) 2014-04-16 EP disclosed
EP-2396340-B1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES INC (US) 2013-12-18 EP disclosed
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 US disclosed
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 US disclosed
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 US disclosed
WO-2010093608-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-19 WO disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 US disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 US disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 US disclosed
EP-1018514-B1 NF-$g(k)B INHIBITORS CONTAINING INDAN DERIVATIVES AS THE ACTIVE INGREDIENT DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-05-12 EP disclosed
US-6734180-B1 NF-κB inhibitor comprising an indan derivative as an active ingredient DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2004-05-11 US disclosed
US-6703421-B1 ADMINISTERING NF-KAPPA B INHIBITOR DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2004-03-09 US disclosed
EP-1132093-A1 PREVENTIVES OR REMEDIES FOR MYOCARDITIS, DILATED CARDIOMYOPATHY AND CARDIAC INSUFFICIENCY CONTAINING NF-KAPPA B INHIBITORS AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 2001-09-12 EP disclosed
EP-1018514-A1 NF-$g(k)B INHIBITORS CONTAINING INDAN DERIVATIVES AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 2000-07-12 EP disclosed
EP-0225182-B1 CEPHALOSPORIN COMPOUNDS ICI PHARMA (FR) 1993-02-10 EP disclosed
US-5013731-A Bactericides ICI PHARMA (FR) 1991-05-07 US disclosed
EP-0225182-A2 Cephalosporin compounds ICI PHARMA (FR) 1987-06-10 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 (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-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, TYMP, MTAP IRAK4 1108/4885ALDH1A1 3094/4885LMNA 1447/4885

“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.