SCHEMBL10171982

SCHEMBL10171982

CS(=O)(=O)OC[C@H]1C[C@@H](COCc2ccccc2)C1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSK P43235 1/20 0.42
TSHR P16473 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
AGTR2 P50052 1/20 0.41
LMNA P02545 1/20 0.40
NAAA Q02083 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
BUB1 O43683 1/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL16398437 0.91 CTSL (0.45) CTSLCTSBCTSKTSHRCA1
SCHEMBL16398438 0.91 CTSL (0.45) CTSLCTSBCTSKTSHRCA1
SCHEMBL17407792 0.85 TSHR (0.41) CTSLCTSBCTSKTSHRCA1
SCHEMBL5788946 0.84 CTSL (0.41) CTSLCTSBCTSKTSHRCA1
SCHEMBL583025 0.84 FFAR1 (0.43) CTSLCTSBCTSKCA1CA2
SCHEMBL29502356 0.82 LMNA (0.37) CTSLCTSBCTSKTSHRCA1
SCHEMBL20282868 0.79 LTA4H (0.47) CTSLCTSBCTSKLMNANAAA
SCHEMBL31586211 0.79 CTSL (0.42) CTSLCTSBCTSKTSHRCA1
SCHEMBL28629464 0.78 AR (0.41) CA1CA2CA9BUB1
SCHEMBL24207209 0.77 TSHR (0.50) CTSLCTSBCTSKTSHRAGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114994-B2 2′ and 3′-substituted cyclobutyl nucleoside analogs for the treatment viral infections and abnormal cellular proliferation EMORY UNIVERSITY (US) 2012-02-14 US disclosed
US-20090149416-A1 2' and 3'-Substituted Cyclobutyl Nucleoside Analogs for the Treatment Viral Infections and Abnormal Cellular Proliferation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-06-11 US disclosed
US-7495006-B2 2′ and 3′-substituted cyclobutyl nucleoside analogs for the treatment of viral infections and abnormal cellular proliferation EMORY UNIVERSITY (US) 2009-02-24 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-20090149416-A1 2' and 3'-Substituted Cyclobutyl Nucleoside Analogs for the Treatment Viral Infections and Abnormal Cellular Proliferation HAVCR2, PNP, PCNA CTSL 810/4885CTSB 701/4885CTSK 2781/4885

“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.