SCHEMBL18378673

SCHEMBL18378673

CCCCCOC(=O)[C@@H](C)N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.52
EPHX1 P07099 1/20 0.48
TSHR P16473 3/20 0.47
ALDH1A1 P00352 2/20 0.46
HTR2C P28335 1/20 0.46
HCAR2 Q8TDS4 2/20 0.46
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ATM Q13315 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
FAAH O00519 1/20 0.43

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
SCHEMBL253585 1.00 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL4672442 1.00 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL3880771 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL15796773 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL5271653 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL4206354 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL10347198 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL4679055 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL5271657 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C
SCHEMBL13797804 0.98 NAAA (0.55) NAAAEPHX1TSHRALDH1A1HTR2C

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
EP-3386512-B1 ANTIVIRAL PHOSPHODIAMIDE PRODRUGS OF TENOFOVIR MERCK SHARP & DOHME LLC (US) 2023-11-22 EP disclosed
US-10745428-B2 Antiviral phosphodiamide prodrugs of tenofovir IDENIX PHARMACEUTICALS LLC (US) 2020-08-18 US disclosed
WO-2017007701-A1 ANTIVIRAL PHOSPHODIAMIDE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2017-01-12 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 (1 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-10745428-B2 Antiviral phosphodiamide prodrugs of tenofovir PNP, TYMP, PPA1 NAAA 285/4885EPHX1 2862/4885TSHR 4347/4885

“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.