SCHEMBL7677720

SCHEMBL7677720

Nc1nc(=O)c2ncc(C(=O)O)nc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 17/20 0.60
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ PMP22 Q01453 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44

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
Pterin-6-Carboxylic Acid SCHEMBL893094 0.88 AKR1B1 (0.56) AKR1B1KDM4EALDH1A1LMNAGLA
Pterin-6-Carboxylic Acid SCHEMBL17439631 0.86 AKR1B1 (0.55) AKR1B1KDM4EALDH1A1LMNAGLA
SCHEMBL4297911 0.78 KDM4E (0.46) AKR1B1KDM4EALDH1A1LMNAGLA
SCHEMBL7682920 0.76 KDM4E (0.47) AKR1B1KDM4EALDH1A1LMNAGLA
SCHEMBL7677717 0.75 AKR1B1 (1.00) AKR1B1
SCHEMBL7677673 0.75 ALDH1A1 (0.47) AKR1B1KDM4EALDH1A1LMNAGLA
SCHEMBL7683620 0.73 KDM4E (0.45) AKR1B1KDM4EALDH1A1LMNAGLA
SCHEMBL4816470 0.72 KDM4E (0.44) AKR1B1KDM4EALDH1A1LMNAGLA
Pterin-6-Carboxylic Acid SCHEMBL893092 0.72 AKR1B1 (0.78) AKR1B1HSD17B10
Pterin-6-Carboxylic Acid SCHEMBL31149841 0.72 AKR1B1 (0.78) AKR1B1HSD17B10

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
EP-3102245-B1 METHODS OF SCREENING, SELECTING, AND IDENTIFYING CYTOTOXIC RECOMBINANT POLYPEPTIDES BASED ON AN INTERIM DIMINUTION OF RIBOTOXICITY MOLECULAR TEMPLATES INC (US) 2021-09-08 — — EP disclosed
US-10421958-B2 Methods of screening, selecting, and identifying cytotoxic recombinant polypeptides based on an interim diminution of ribotoxicity MOLECULAR TEMPLATES, INC. (US) 2019-09-24 — — US disclosed
EP-3102245-A2 METHODS OF SCREENING, SELECTING, AND IDENTIFYING CYTOTOXIC RECOMBINANT POLYPEPTIDES BASED ON AN INTERIM DIMINUTION OF RIBOTOXICITY Molecular Templates, Inc. (US) 2016-12-14 — — EP disclosed
US-20160355803-A1 METHODS OF SCREENING, SELECTING, AND IDENTIFYING CYTOTOXIC RECOMBINANT POLYPEPTIDES BASED ON AN INTERIM DIMINUTION OF RIBOTOXICITY MOLECULAR TEMPLATES, INC. (US) 2016-12-08 — — US disclosed
WO-2015120058-A9 METHODS OF SCREENING, SELECTING, AND IDENTIFYING CYTOTOXIC RECOMBINANT POLYPEPTIDES BASED ON AN INTERIM DIMINUTION OF RIBOTOXICITY MOLECULAR TEMPLATES, INC. (US) 2016-06-02 — — WO disclosed
WO-2015120058-A2 METHODS OF SCREENING, SELECTING, AND IDENTIFYING CYTOTOXIC RECOMBINANT POLYPEPTIDES BASED ON AN INTERIM DIMINUTION OF RIBOTOXICITY MOLECULAR TEMPLATES, INC. (US) 2015-08-13 — — WO disclosed
US-6358953-B1 ADMINISTERING PTERIN METAL COMPLEX AS ANTICARCINOGENIC AGENTS AND VIRICIDES Moheno, Phillip B. B. 2002-03-19 — — US disclosed
EP-1123294-A1 NOVEL PTERIN ANTINEOPLASTIC AGENTS Moheno, Phillip B. B. (US) 2001-08-16 — — EP disclosed
WO-2000023448-A1 NOVEL PTERIN ANTINEOPLASTIC AGENTS MOHENO PHILLIP B B (US) 2000-04-27 — — WO disclosed
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