SCHEMBL14989469

SCHEMBL14989469

CCC(CC)COC(=O)[C@H](C)NP(=O)(Oc1ccccc1)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ BCHE P06276 1/20 0.43
▸ ACHE P22303 1/20 0.43
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ BTN3A1 O00481 4/20 0.40
▸ MAPT P10636 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40

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
SCHEMBL17712317 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2BCHEACHE
SCHEMBL28854869 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2BCHEACHE
SCHEMBL28645682 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2BCHEACHE
SCHEMBL14989468 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2BCHEACHE
SCHEMBL17712318 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2BCHEACHE
SCHEMBL16554025 0.97 CA1 (0.45) ALDH1A1CA1CA2BCHEACHE
SCHEMBL16554022 0.97 CA1 (0.45) ALDH1A1CA1CA2BCHEACHE
SCHEMBL16566219 0.92 ALDH1A1 (0.43) ALDH1A1CA1CA2BCHEACHE
SCHEMBL23819216 0.91 BTN3A1 (0.44) ALDH1A1CA1CA2BCHEACHE
SCHEMBL13469579 0.90 ALDH1A1 (0.47) ALDH1A1CA1CA2BCHEACHE

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 114 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12485135-B2 Nicotinamide mononucleotide derivatives and their uses METRO INTERNATIONAL BIOTECH, LLC (US) 2025-12-02 — — US disclosed
EP-4598934-A1 4'-THIONUCLEOSIDE ANALOGUES AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES, INC. (US) 2025-08-13 — — EP disclosed
EP-4591935-A2 METHODS FOR THE PREPARATION OF RIBOSIDES Gilead Sciences, Inc. (US) 2025-07-30 — — EP disclosed
EP-4588928-A2 METHODS FOR TREATING FILOVIRIDAE VIRUS INFECTIONS Gilead Sciences, Inc. (US) 2025-07-23 — — EP disclosed
EP-4036099-B1 METHODS FOR THE PREPARATION OF RIBOSIDES GILEAD SCIENCES INC (US) 2025-03-19 — — EP disclosed
US-20240350523-A1 NICOTINAMIDE MONONUCLEOTIDE DERIVATIVES AND THEIR USES METROBIOTECH, LLC 2024-10-24 — — US disclosed
US-20240226130-A1 4'-THIONUCLEOSIDE ANALOGUES AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES, INC. 2024-07-11 — — US disclosed
US-12030906-B2 Crystalline forms of (s)-2-ethylbutyl 2-(((s)-(((2r,3s,4r,5r)-5-(4-aminopyrrolo[2,1-f] [1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methoxy) (phenoxy) phosphoryl)amino)propanoate GILEAD SCIENCES, INC. (US) 2024-07-09 — — US disclosed
WO-2024076915-A1 4'-THIONUCLEOSIDE ANALOGUES AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES, INC. (US) 2024-04-11 — — WO disclosed
US-11878027-B2 Nicotinamide mononucleotide derivatives and their uses METRO INTERNATIONAL BIOTECH, LLC (US) 2024-01-23 — — US disclosed
WO-2015069939-A1 PYRROLO [1,2,F] [1,2,4] TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2015-05-14 — — WO disclosed
WO-2015069939-A1 PYRROLO [1,2,F] [1,2,4] TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. (US) 2015-05-14 — — WO disclosed
US-20140066398-A1 HCV POLYMERASE INHIBITORS MEDIVIR, AB (SE) 2014-03-06 — — US disclosed
US-20140066398-A1 HCV POLYMERASE INHIBITORS MEDIVIR, AB (SE) 2014-03-06 — — US disclosed
US-20140066398-A1 HCV POLYMERASE INHIBITORS MEDIVIR, AB (SE) 2014-03-06 — — US disclosed
WO-2013084165-A1 HCV POLYMERASE INHIBITORS MEDIVIR AB (SE) 2013-06-13 — — WO disclosed
WO-2013084165-A1 HCV POLYMERASE INHIBITORS MEDIVIR AB (SE) 2013-06-13 — — WO disclosed
US-20130143835-A1 HCV Polymerase Inhibitors MEDIVIR AB (SE) 2013-06-06 — — US disclosed
US-20130143835-A1 HCV Polymerase Inhibitors MEDIVIR AB (SE) 2013-06-06 — — US disclosed
US-20130143835-A1 HCV Polymerase Inhibitors MEDIVIR AB (SE) 2013-06-06 — — 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 (7 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-12030906-B2 Crystalline forms of (s)-2-ethylbutyl 2-(((s)-(((2r,3s,4r,5r)-5-(4-aminopyrrolo[2,1-f] [1,2,4]triazin-7-yl)-5-cyano-3,4-dihydroxytetrahydrofuran-2-yl)methoxy) (phenoxy) phosphoryl)amino)propanoate SARS1, MTAP, PNP ALDH1A1 2466/4885CA1 2937/4885CA2 1218/4885
US-20240226130-A1 4'-THIONUCLEOSIDE ANALOGUES AND THEIR PHARMACEUTICAL USE TYMP, MTAP, TPMT ALDH1A1 2800/4885CA1 4697/4885CA2 4793/4885
US-20130143835-A1 HCV Polymerase Inhibitors POLI, HAVCR2, EIF2AK2 ALDH1A1 362/4885CA1 4846/4885CA2 4660/4885
US-12485135-B2 Nicotinamide mononucleotide derivatives and their uses NAMPT, NNT, NQO1 ALDH1A1 1078/4885CA1 4763/4885CA2 2632/4885
US-11878027-B2 Nicotinamide mononucleotide derivatives and their uses NAMPT, NNT, NQO1 ALDH1A1 1078/4885CA1 4763/4885CA2 2632/4885
US-20240350523-A1 NICOTINAMIDE MONONUCLEOTIDE DERIVATIVES AND THEIR USES NAMPT, NNT, NQO1 ALDH1A1 1078/4885CA1 4763/4885CA2 2632/4885
US-20140066398-A1 HCV POLYMERASE INHIBITORS POLI, HAVCR2, EIF2AK2 ALDH1A1 362/4885CA1 4846/4885CA2 4660/4885

“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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