SCHEMBL2176031

SCHEMBL2176031

O=c1ccn([C@]2(F)O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 11/20 0.47
P2RY14 Q15391 2/20 0.46
POLA1 P09884 1/20 0.46
P2RY2 P41231 8/20 0.45
P2RY4 P51582 4/20 0.45
ADSS2 P30520 1/20 0.45

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
SCHEMBL2800175 0.92 P2RY6 (0.58) P2RY6P2RY14POLA1P2RY2P2RY4
SCHEMBL4267966 0.91 P2RY6 (0.46) P2RY6P2RY14POLA1P2RY2P2RY4
SCHEMBL34463723 0.91 P2RY14 (0.45) P2RY6P2RY14POLA1P2RY2P2RY4
SCHEMBL607049 0.90 POLA1 (0.60) P2RY6POLA1P2RY2P2RY4
SCHEMBL11688927 0.88 P2RY6 (0.45) P2RY6P2RY14POLA1P2RY2P2RY4
Pyrophosphoric Acid SCHEMBL2800166 0.86 P2RY6 (0.46) P2RY6P2RY14POLA1P2RY2P2RY4
SCHEMBL18486630 0.85 P2RY2 (0.48) P2RY6P2RY14P2RY2P2RY4ADSS2
Phosphoric Acid SCHEMBL607047 0.85 SLC28A1 (0.45) P2RY6P2RY14P2RY2P2RY4
Phosphoric Acid SCHEMBL2176024 0.85 SLC28A1 (0.45) P2RY6P2RY14P2RY2P2RY4
SCHEMBL32679517 0.84 P2RY2 (0.45) P2RY6P2RY14P2RY2P2RY4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12357617-B2 Discovery of novel anti-infectives for gram negative pathogens THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-07-15 US disclosed
CN-119633010-A 4' -Halogen-containing nucleotide and nucleoside therapeutic compositions and related uses 埃默里大学 2025-03-18 CN disclosed
CN-114206896-B Cyclic deoxyribonucleotide compounds 纽科利制药公司 2024-12-17 CN disclosed
CN-112074506-B 4' -Halogen-containing nucleotide and nucleoside therapeutic compositions and related uses 埃默里大学 2024-10-11 CN disclosed
CN-118477090-A 4' -Halogen-containing nucleotide and nucleoside therapeutic compositions and related uses 埃默里大学 2024-08-13 CN disclosed
EP-3538151-B1 HUMAN PLASMA-LIKE MEDIUM WHITEHEAD INST BIOMEDICAL RES (US) 2024-06-26 EP disclosed
CN-114867351-B 4' -Halogen-containing nucleotide and nucleoside therapeutic compositions and related uses 埃默里大学 2024-04-23 CN disclosed
CN-117563014-A Antibody-drug gene conjugate and application thereof 上海交通大学 2024-02-20 CN disclosed
US-20230132256-A1 COMBINATION THERAPY OWL ROCK OPPORTUNISTIC MASTER FUND I, L.P. 2023-04-27 US disclosed
US-20230051644-A1 HUMAN PLASMA-LIKE MEDIUM WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH 2023-02-16 US disclosed
EP-1100964-A1 GENE SEQUENCE VARIANCES WITH UTILITY IN DETERMINING THE TREATMENT OF DISEASE Variagenics, Inc. (US) 2001-05-23 EP disclosed
WO-2000004194-A1 GENE SEQUENCE VARIANCES WITH UTILITY IN DETERMINING THE TREATMENT OF DISEASE VARIAGENICS, INC. (US) 2000-01-27 WO disclosed
US-5968914-A Treatment of chemotherapeutic agent and antiviral agent toxicity with acylated pyrimidine nucleosides PRO-NEURON, INC. (US) 1999-10-19 US disclosed
US-5859295-A Canavanine analogs and their use as chemotherapeutic agents UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 1999-01-12 US disclosed
EP-0831849-A1 METHODS OF REDUCING TOXICITY OF CHEMOTHERAPEUTIC AND ANTIVIRAL AGENTS WITH ACYLATED PYRIMIDINE NUCLEOSIDES PRO-NEURON, INC. (US) 1998-04-01 EP disclosed
WO-1996040165-A1 METHODS OF REDUCING TOXICITY OF CHEMOTHERAPEUTIC AND ANTIVIRAL AGENTS WITH ACYLATED PYRIMIDINE NUCLEOSIDES PRO-NEURON, INC. (US) 1996-12-19 WO disclosed
EP-0746336-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1996-12-11 EP disclosed
US-5552440-A Use of L-canavanine as a chemotherapeutic agent for the treatment of pancreatic cancer THE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 1996-09-03 US disclosed
EP-0746336-A4 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN INC (US) 1996-07-26 EP disclosed
WO-1993002703-A1 PRODRUGS ACTIVATED BY TARGETED CATALYTIC PROTEINS IGEN, INC. (US) 1993-02-18 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-20230132256-A1 COMBINATION THERAPY IL2RA, IL2, CD22 P2RY6 1555/4885P2RY14 2387/4885POLA1 3814/4885
US-12357617-B2 Discovery of novel anti-infectives for gram negative pathogens BET1, BOLA2; BOLA2B, BRD2 P2RY6 3919/4885P2RY14 3257/4885POLA1 3482/4885

“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.