SCHEMBL18787319

SCHEMBL18787319

Nc1ncnn2c([C@@H]3O[C@H](COCc4ccccc4)[C@@H](OCc4ccccc4)[C@H]3F)cnc12

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 2/20 0.50
▸ HTR1A P08908 1/20 0.39
▸ HSPA5 P11021 2/20 0.38
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ PTPN1 P18031 6/20 0.35
▸ CDC25B P30305 6/20 0.35
▸ GJB2 P29033 2/20 0.35
▸ PTPN2 P17706 2/20 0.34
▸ PTPN6 P29350 2/20 0.34
▸ PTPN11 Q06124 2/20 0.34
▸ SSTR1 P30872 1/20 0.34
▸ SSTR2 P30874 1/20 0.34
▸ SSTR4 P31391 1/20 0.34
▸ SSTR3 P32745 1/20 0.34
▸ SSTR5 P35346 1/20 0.34
▸ NT5E P21589 1/20 0.33
▸ BCHE P06276 1/20 0.33

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
SCHEMBL25379329 0.92 PDE2A (0.44) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL17106844 0.92 PDE2A (0.44) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL18490316 0.92 PDE2A (0.44) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL20434839 0.92 PDE2A (0.44) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL17106846 0.92 PDE2A (0.44) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL29397234 0.87 PDE2A (0.43) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL24557909 0.87 PDE2A (0.43) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL18787315 0.87 PDE2A (0.52) PDE2AHTR1AHSPA5CA1CA2
SCHEMBL22569895 0.86 PDE2A (0.42) PDE2AHTR1ACA1CA2CA9
SCHEMBL29397763 0.86 PDE2A (0.42) PDE2AHTR1ACA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787832-B2 2′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2023-10-17 — — US disclosed
US-20210253622-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2021-08-19 — — US disclosed
US-10941177-B2 2′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2021-03-09 — — US disclosed
US-20190016749-A1 2'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2019-01-17 — — US disclosed
US-20170114086-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2017-04-27 — — 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 (5 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-20210253622-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, SLC29A1, RNMT PDE2A 507/4885HTR1A 1362/4885HSPA5 4595/4885
US-20190016749-A1 2'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, SLC29A1, RNMT PDE2A 507/4885HTR1A 1362/4885HSPA5 4595/4885
US-20170114086-A1 2'- SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, SLC29A1, RNMT PDE2A 507/4885HTR1A 1362/4885HSPA5 4595/4885
US-11787832-B2 2′-substituted carba-nucleoside analogs for antiviral treatment PNP, RNMT, SLC29A1 PDE2A 491/4885HTR1A 1442/4885HSPA5 4575/4885
US-10941177-B2 2′-substituted carba-nucleoside analogs for antiviral treatment PNP, RNMT, SLC29A1 PDE2A 491/4885HTR1A 1442/4885HSPA5 4575/4885

“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.

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