SCHEMBL4299948

SCHEMBL4299948

CCCC(=O)N1CN([C@@H]2O[C@H](C)C(O)C2O)c2ncnc(N)c21

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADK P55263 11/20 0.43
FBP1 P09467 1/20 0.39
HSPA8 P11142 1/20 0.39
HSP90B1 P14625 3/20 0.35
HSP90AA1 P07900 2/20 0.35
ADORA3 P0DMS8 2/20 0.35
ADORA2A P29274 2/20 0.35
ADORA2B P29275 2/20 0.35
ADORA1 P30542 2/20 0.35
AHCY P23526 1/20 0.34
TSHR P16473 2/20 0.34
CYP2C19 P33261 1/20 0.34
TMIGD3 P0DMS9 1/20 0.34
MAPK1 P28482 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL10005056 0.74 HSPA8 (0.41) ADKFBP1HSPA8ADORA3AHCY
SCHEMBL2197504 0.73 CDK1 (0.48) ADKHSPA8ADORA3ADORA2AADORA2B
SCHEMBL11043640 0.71 HSPA8 (0.39) ADKFBP1HSPA8ADORA3
SCHEMBL7110520 0.71 SARS1 (0.43) ADKFBP1HSPA8
SCHEMBL11165275 0.70 HSPA8 (0.38) ADKFBP1HSPA8ADORA3
SCHEMBL11041141 0.69 HSPA8 (0.37) ADKFBP1HSPA8
SCHEMBL11042514 0.68 HSPA8 (0.37) ADKFBP1HSPA8
SCHEMBL11040775 0.68 SRM (0.37) ADKFBP1HSPA8
SCHEMBL11040836 0.68 SRM (0.37) ADKFBP1HSPA8
SCHEMBL11310700 0.68 HSPA8 (0.36) ADKFBP1HSPA8ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219518-A2 BIOCONJUGATES OF HETEROCYCLIC COMPOUNDS Taizhou Huifeng Hetai Biotechnology Co. Ltd (CN) 2023-08-02 EP disclosed
EP-3337804-A1 BIOCONJUGATES OF HETEROCYCLIC COMPOUNDS Arthus Biosystems LLC (US) 2018-06-27 EP disclosed
WO-2016164504-A1 BIOCONJUGATES OF HETEROCYCLIC COMPOUNDS ARTHUS BIOSYSTEMS LLC (US) 2016-10-13 WO disclosed
US-8344115-B2 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2013-01-01 US disclosed
WO-2009131643-A1 IMMUNOASSAY FOR SPECIFIC DETERMINATION OF S-ADENOSYMETHIONINE AND ANALOGS THEREOF IN BIOLOGICAL SAMPLES MONABIO, INC. (US) 2009-10-29 WO disclosed
US-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples HAO, XIUJUAN 2009-10-22 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 (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-20090263879-A1 Immunoassay for specific determination of S-adenosylmethionine and analogs thereof in biological samples AHCY, MAT2A, MAT1A ADK 310/4885FBP1 485/4885HSPA8 2965/4885

“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.