SCHEMBL1551604

SCHEMBL1551604

NCc1nc2ncncc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.44
METAP1 P53582 1/20 0.44
CACNA1H O95180 1/20 0.37
NPY5R Q15761 1/20 0.35
ENPP1 P22413 1/20 0.32
ITGB3 P05106 1/20 0.31
ITGAV P06756 1/20 0.31
PI4KA P42356 1/20 0.30
PI4K2B Q8TCG2 1/20 0.30
PI4K2A Q9BTU6 1/20 0.30
PI4KB Q9UBF8 1/20 0.30

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
SCHEMBL9936013 0.81 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL4957462 0.81 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL9572857 0.81 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL10857663 0.81 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL4957389 0.81 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL1193887 0.81 METAP2 (0.44) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL4955472 0.79 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL30884953 0.79 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL29208955 0.79 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3
SCHEMBL9569994 0.79 METAP2 (0.42) METAP2METAP1NPY5RENPP1ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111132721-B Multiple-inflation type intravascular medical device W.L.戈尔及同仁股份有限公司 2022-07-19 CN disclosed
CN-109689692-B Bispecific antibodies and antibody conjugates for tumor therapy and uses thereof 本康生物制药(深圳)有限公司 2021-11-12 CN disclosed
CN-110651996-A Food for nourishing and improving kidney function and preparation method thereof 马晨光 2020-01-07 CN disclosed
CN-104017746-B Lactobacillus, composition thereof and application of lactobacillus in preparation of medicines for treating heart and liver diseases caused by lupus erythematosus 景岳生物科技股份有限公司 2017-08-22 CN disclosed
CN-104017746-A Lactobacillus, compositions thereof and use for treating autoimmune diseases and complications GENMONT BIOTECH INC 2014-09-03 CN disclosed
US-20110251172-A1 PURINE DERIVATIVES FOR TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME CORP. 2011-10-13 US disclosed
EP-2312945-A1 PURINE DERIVATIVES FOR TREATMENT OF ALZHEIMER'S DISEASE Merck Sharp & Dohme Corp. (US) 2011-04-27 EP disclosed
WO-2010019392-A1 PURINE DERIVATIVES FOR TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME CORP. (US) 2010-02-18 WO disclosed
EP-1176959-B1 NOVEL PROLINES AS ANTIMICROBIAL AGENTS MERCK & CO INC (US) 2006-03-08 EP disclosed
US-6579894-B2 Bactericides, fungicides MERCK & CO., INC. 2003-06-17 US disclosed
US-20030013724-A1 Novel prolines as antimicrobial agents HAMMOND MILTON L (US) 2003-01-16 US disclosed
US-6417217-B1 TREATING INFECTIONS WITH HETEROCYCLIC MICROBIOCIDES THIS INVENTION RELATES TO THE FIELD OF TRANSFER RIBONUCLEIC ACID (TRNA) SYNTHETASE INHIBITORS, THEIR PREPARATION AND THEIR USE AS ANTIMICROBIAL ADMINISTERING TO THE SUBJECT A MERCK & CO., INC. 2002-07-09 US disclosed
US-6333344-B1 ENZYME INHIBITORS AND BACTERICIDES MERCK & CO. 2001-12-25 US disclosed
EP-0562832-A1 Indole and indazole derivatives, for the treatment and prophylaxis of cerebral disorders, their preparation and their use SANKYO COMPANY LIMITED (JP) 1993-09-29 EP disclosed
EP-0069507-A2 Hydrocarbon compositions containing heteroaromatic nitrogen compounds EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-01-12 EP 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-20030013724-A1 Novel prolines as antimicrobial agents AARS1, EPRS1, TRMT1 METAP2 1792/4885METAP1 1404/4885CACNA1H 4769/4885
US-20110251172-A1 PURINE DERIVATIVES FOR TREATMENT OF ALZHEIMER'S DISEASE BACE1, APP, PSEN1 METAP2 295/4885METAP1 179/4885CACNA1H 3098/4885

“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.