SCHEMBL3040267

SCHEMBL3040267

OC[C@@H]1C=C[C@H](n2cnc3c(Cl)nc(Cl)nc32)C1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.55
NR1I2 O75469 1/20 0.55
ALB P02768 1/20 0.55
LMNA P02545 3/20 0.52
TP53 P04637 3/20 0.52
PNP P00491 1/20 0.43
HTT P42858 1/20 0.43
PDE3A Q14432 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ADCY5 O95622 6/20 0.42
ABCB1 P08183 3/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL30827047 1.00 PDE4D (0.55) PDE4DNR1I2ALBLMNATP53
SCHEMBL31454794 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL7099022 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL6764237 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL7654778 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL31454816 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL13789990 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL6694128 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL14048997 0.88 NR1I2 (0.67) PDE4DNR1I2ALBLMNATP53
SCHEMBL29323130 0.88 PDE4D (0.53) PDE4DNR1I2ALBLMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES EMORY UNIVERSITY 2024-07-18 US disclosed
US-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES EMORY UNIVERSITY 2024-07-18 US disclosed
US-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES EMORY UNIVERSITY 2024-07-18 US disclosed
EP-4319763-A2 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES Emory University (US) 2024-02-14 EP disclosed
WO-2022217154-A2 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES EMORY UNIVERSITY (US) 2022-10-13 WO disclosed
US-20100204463-A1 Preparation Of Synthetic Nucleosides via Pi-Allyl Transition Metal Complex Formation EMORY UNIVERSITY 2010-08-12 US disclosed
US-20100204463-A1 Preparation Of Synthetic Nucleosides via Pi-Allyl Transition Metal Complex Formation EMORY UNIVERSITY 2010-08-12 US disclosed
US-20100204463-A1 Preparation Of Synthetic Nucleosides via Pi-Allyl Transition Metal Complex Formation EMORY UNIVERSITY 2010-08-12 US disclosed
WO-2009021114-A1 PREPARATION OF SYNTHETIC NUCLEOSIDES VIA π-ALLYL TRANSITION METAL COMPLEX FORMATION EMORY UNIVERSITY (US) 2009-02-12 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-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES MTAP, PNP, SARS1 PDE4D 1024/4885NR1I2 3733/4885ALB 239/4885
US-20100204463-A1 Preparation Of Synthetic Nucleosides via Pi-Allyl Transition Metal Complex Formation PAICS, POLRMT, ZC3HAV1 PDE4D 3060/4885NR1I2 4076/4885ALB 3421/4885

“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.