SCHEMBL600101

SCHEMBL600101

O=c1[nH]c(=O)n(C2CC(CO)C2O)cc1F

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MAPT P10636 2/20 0.48
TSHR P16473 1/20 0.48
PMP22 Q01453 1/20 0.48
HBB P68871 1/20 0.48
TK1 P04183 5/20 0.46
ESR1 P03372 1/20 0.44
NT5E P21589 1/20 0.40
P2RY6 Q15077 1/20 0.40
P2RY14 Q15391 1/20 0.40
ALOX12 P18054 1/20 0.39
ADRA1A P35348 1/20 0.39

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
SCHEMBL10515432 1.00 LMNA (0.56) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL10171969 1.00 LMNA (0.56) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL10514666 1.00 LMNA (0.56) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL10515491 1.00 LMNA (0.56) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL600100 1.00 LMNA (0.56) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL29325519 0.96 LMNA (0.55) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL22902101 0.96 LMNA (0.55) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL29323413 0.96 LMNA (0.55) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL29325522 0.96 LMNA (0.55) LMNASMN1; SMN2MAPTTSHRPMP22
SCHEMBL9311378 0.92 LMNA (0.62) LMNASMN1; SMN2MAPTTSHRPMP22

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 5 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
US-20060223835-A1 2' and 3'- substituted cyclobutyl nucleoside analogs for the treatment of viral infections and abnormal cellular proliferation EMORY UNIVERSITY 2006-10-05 US disclosed
EP-0330992-A2 Novel cyclobutane Derivatives, processes for their preparation and pharmaceutical compositions comprising them Nippon Kayaku Kabushiki Kaisha (JP) 1989-09-06 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-20090149416-A1 2' and 3'-Substituted Cyclobutyl Nucleoside Analogs for the Treatment Viral Infections and Abnormal Cellular Proliferation HAVCR2, PNP, PCNA LMNA 2156/4885SMN1; SMN2 1275/4885MAPT 2646/4885
US-20060223835-A1 2' and 3'- substituted cyclobutyl nucleoside analogs for the treatment of viral infections and abnormal cellular proliferation HAVCR2, PNP, DCTD LMNA 2607/4885SMN1; SMN2 1385/4885MAPT 2376/4885

“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.