SCHEMBL5668043

SCHEMBL5668043

C1=CN(Cc2ccccc2)CN=C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.41
CYP19A1 P11511 4/20 0.38
KDM4E B2RXH2 2/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
F2 P00734 1/20 0.35
PLG P00747 1/20 0.35
ELANE P08246 1/20 0.35
CTSG P08311 1/20 0.35
CMA1 P23946 1/20 0.35
CTRC Q99895 1/20 0.35
MC4R P32245 1/20 0.35
GAA P10253 2/20 0.35
ALDH1A1 P00352 3/20 0.34
POLB P06746 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DRD4 P21917 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL28113285 0.82 LMNA (0.40) CYP19A1GAAALDH1A1POLBCYP1A2
SCHEMBL28855639 0.82 SLC6A3 (0.42) SIGMAR1GAAL3MBTL1CYP1A2CYP2D6
SCHEMBL28193189 0.78 SIGMAR1 (0.44) SIGMAR1KDM4ECMA1GAAALDH1A1
SCHEMBL28137179 0.78 KDM4E (0.45) KDM4EALDH1A1L3MBTL1
SCHEMBL32688445 0.77 HCRTR1 (0.33) SIGMAR1KDM4ECMA1GAAALDH1A1
SCHEMBL27450821 0.76 ALDH1A1 (0.35) ALDH1A1DRD4
SCHEMBL28238610 0.73 HTT (0.42) KDM4ETSHRALDH1A1L3MBTL1DRD4
SCHEMBL28230095 0.73 TSHR (0.37) KDM4ETSHRNPSR1GAAALDH1A1
SCHEMBL7057369 0.71 ALDH1A1 (0.42) KDM4ENPSR1GAAALDH1A1POLB
SCHEMBL23290132 0.71

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-12485121-B2 Antiviral agents for the treatment and prevention of HIV infection PHARMASYNTEZ, JOINT STOCK COMPANY (RU) 2025-12-02 US disclosed
US-20230120294-A1 ANTIVIRAL AGENTS FOR THE TREATMENT AND PREVENTION OF HIV INFECTION PHARMASYNTEZ, JOINT STOCK COMPANY (RU) 2023-04-20 US disclosed
CN-115279757-A Pyrimidine bicyclic compounds as antiviral agents for the treatment and prevention of HIV infection 法玛西泰股份公司 2022-11-01 CN disclosed
EP-3455205-A1 PEPTIDOMIMETICS FOR THE TREATMENT OF NOROVIRUS INFECTION Emory University (US) 2019-03-20 EP disclosed
WO-2017197377-A1 PEPTIDOMIMETICS FOR THE TREATMENT OF NOROVIRUS INFECTION EMORY UNIVERSITY (US) 2017-11-16 WO disclosed
WO-2017075590-A2 PROCESSES FOR PREPARING 2-DIHALO RIBOLACTONES COCRYSTAL PHARMA, INC. (US) 2017-05-04 WO disclosed
EP-3134423-A1 2' -DISUBSTITUTED NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER Cocrystal Pharma, Inc. (US) 2017-03-01 EP disclosed
WO-2015164812-A1 2' -DISUBSTITUTED NUCLEOSIDE ANALOGS FOR TREATMENT OF THE FLAVIVIRIDAE FAMILY OF VIRUSES AND CANCER COCRYSTAL PHARMA, INC. (US) 2015-10-29 WO disclosed
EP-1461041-A4 PREPARATION OF INTERMEDIATES USEFUL IN THE SYNTHESIS OF ANTIVIRAL NUCLEOSIDES PHARMASSET LTD (BB) 2006-03-29 EP disclosed
EP-1461041-A2 PREPARATION OF INTERMEDIATES USEFUL IN THE SYNTHESIS OF ANTIVIRAL NUCLEOSIDES Pharmasset Ltd. (BB) 2004-09-29 EP disclosed
EP-1373288-A1 PROCESS FOR THE PREPARATION OF 2'-HALO-BETA-L-ARABINOFURANOSYL NUCLEOSIDES Triangle Pharmaceuticals Inc. (US) 2004-01-02 EP disclosed
WO-2003051298-A2 PREPARATION OF INTERMEDIATES USEFUL IN THE SYNTHESIS OF ANTIVIRAL NUCLEOSIDES PHARMASSET LTD. (BB) 2003-06-26 WO disclosed
WO-2002079213-A1 PROCESS FOR THE PREPARATION OF 2'-HALO-$G(B)-L-ARABINOFURANOSYL NUCLEOSIDES TRIANGLE PHARMACEUTICALS, INC. (US) 2002-10-10 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 (2 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-12485121-B2 Antiviral agents for the treatment and prevention of HIV infection TYMP, TYMS, UMPS SIGMAR1 3799/4885CYP19A1 4187/4885KDM4E 2715/4885
US-20230120294-A1 ANTIVIRAL AGENTS FOR THE TREATMENT AND PREVENTION OF HIV INFECTION TYMP, TYMS, UMPS SIGMAR1 3799/4885CYP19A1 4187/4885KDM4E 2715/4885

“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.