SCHEMBL19765997

SCHEMBL19765997

CN(C)c1nc(N)nc2c1ncn2[C@@H]1O[C@@](CO)(CCl)[C@@H](O)[C@H]1F

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TMIGD3 P0DMS9 2/20 0.41
▸ HTR2C P28335 2/20 0.41
▸ HTR2B P41595 2/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ SLC29A1 Q99808 10/20 0.39
▸ ADORA3 P0DMS8 3/20 0.39
▸ ADORA1 P30542 3/20 0.39
▸ PDE2A O00408 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ PDE4D Q08499 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ PGK1 P00558 1/20 0.38
▸ PGK2 P07205 1/20 0.38
▸ HSP90B1 P14625 1/20 0.35
▸ ADORA2B P29275 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
SCHEMBL19766096 0.91 CYP2C19 (0.42) TMIGD3HTR2CHTR2BCYP2C19SLC29A1
SCHEMBL19766095 0.91 CYP2C19 (0.42) TMIGD3HTR2CHTR2BCYP2C19SLC29A1
SCHEMBL20724608 0.88 CYP2C19 (0.36) TMIGD3HTR2CHTR2BCYP2C19SLC29A1
SCHEMBL20724396 0.86 NT5E (0.40) —
SCHEMBL19766008 0.85 TMIGD3 (0.43) TMIGD3HTR2CHTR2BCYP2C19SLC29A1
SCHEMBL19766052 0.85 TMIGD3 (0.43) TMIGD3HTR2CHTR2BCYP2C19SLC29A1
SCHEMBL19766020 0.85 ADORA3 (0.56) HTR2CHTR2BADORA3ADORA1ADORA2A
SCHEMBL19766012 0.85 ADORA3 (0.56) HTR2CHTR2BADORA3ADORA1ADORA2A
SCHEMBL20724397 0.83 P2RY1 (0.43) —
SCHEMBL20724314 0.82 NT5E (0.35) CYP2C19SLC29A1ADORA3ADORA1PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10202412-B2 β-D-2′-deoxy-2′-substituted-4′-substituted-2-substituted-N6-substituted-6-aminopurinenucleotides for the treatment of paramyxovirus and orthomyxovirus infections Atea Pharmaceuticals, Inc. (US) 2019-02-12 — — US disclosed
US-20180009836-A1 BETA-D-2'-DEOXY-2'-SUBSTITUTED-4'-SUBSTITUTED-2-SUBSTITUTED-N6-SUBSTITUTED-6-AMINOPURINENUCLEOTIDES FOR THE TREATMENT OF PARAMYXOVIRUS AND ORTHOMYXOVIRUS INFECTIONS Atea Pharmaceuticals, Inc. (US) 2018-01-11 — — 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 (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-20180009836-A1 BETA-D-2'-DEOXY-2'-SUBSTITUTED-4'-SUBSTITUTED-2-SUBSTITUTED-N6-SUBSTITUTED-6-AMINOPURINENUCLEOTIDES FOR THE TREATMENT OF PARAMYXOVIRUS AND ORTHOMYXOVIRUS INFECTIONS MTAP, NSUN2, TPMT TMIGD3 3883/4885HTR2C 2660/4885HTR2B 2372/4885
US-10202412-B2 β-D-2′-deoxy-2′-substituted-4′-substituted-2-substituted-N6-substituted-6-aminopurinenucleotides for the treatment of paramyxovirus and orthomyxovirus infections MTAP, NSUN2, PNP TMIGD3 3864/4885HTR2C 2753/4885HTR2B 2298/4885

“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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