SCHEMBL26025458

SCHEMBL26025458

CCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc2ccccc2)[C@@H](O)[C@@]1(C)F

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.60
CYP2C9 P11712 2/20 0.60
P2RX3 P56373 1/20 0.45
P2RX2 Q9UBL9 1/20 0.45
DOT1L Q8TEK3 1/20 0.40
P2RY12 Q9H244 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
DNPH1 O43598 1/20 0.39
SLC29A1 Q99808 1/20 0.38
ADORA2A P29274 1/20 0.38

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
SCHEMBL26025471 1.00 CYP3A4 (0.60) CYP3A4CYP2C9P2RX3P2RX2DOT1L
SCHEMBL26025470 1.00 CYP3A4 (0.60) CYP3A4CYP2C9P2RX3P2RX2DOT1L
SCHEMBL26025452 0.96 CYP3A4 (0.61) CYP3A4CYP2C9P2RX3P2RX2ADORA3
SCHEMBL26025451 0.96 CYP3A4 (0.61) CYP3A4CYP2C9P2RX3P2RX2ADORA3
SCHEMBL26025456 0.96 CYP3A4 (0.61) CYP3A4CYP2C9P2RX3P2RX2ADORA3
SCHEMBL26029346 0.94 CYP3A4 (0.64) CYP3A4CYP2C9P2RX3P2RX2P2RY12
SCHEMBL26029347 0.94 CYP3A4 (0.64) CYP3A4CYP2C9P2RX3P2RX2P2RY12
SCHEMBL26029321 0.94 CYP3A4 (0.64) CYP3A4CYP2C9P2RX3P2RX2P2RY12
SCHEMBL26029344 0.94 CYP3A4 (0.64) CYP3A4CYP2C9P2RX3P2RX2P2RY12
SCHEMBL26029348 0.94 CYP3A4 (0.64) CYP3A4CYP2C9P2RX3P2RX2P2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364121-A1 NIRAN INTERFERING DRUGS FOR SARS-COV-2 MUTANT THERAPY Atea Pharmaceuticals, Inc. (US) 2023-11-16 US disclosed
US-11813278-B2 Highly active compounds against COVID-19 Atea Pharmaceuticals, Inc. (US) 2023-11-14 US disclosed
US-11738038-B2 Highly active compounds against COVID-19 Atea Pharmaceuticals, Inc. (US) 2023-08-29 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 (3 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-20230364121-A1 NIRAN INTERFERING DRUGS FOR SARS-COV-2 MUTANT THERAPY NSUN2, ACE2, PNP CYP3A4 344/4885CYP2C9 1644/4885P2RX3 2944/4885
US-11813278-B2 Highly active compounds against COVID-19 PNP, ACE2, MTAP CYP3A4 1696/4885CYP2C9 944/4885P2RX3 138/4885
US-11738038-B2 Highly active compounds against COVID-19 PNP, ACE2, MTAP CYP3A4 1696/4885CYP2C9 944/4885P2RX3 138/4885

“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.