SCHEMBL4501110

SCHEMBL4501110

O=c1c(Cl)cn([C@@H]2CC[C@H](CO)O2)c(=O)n1F

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.41
ALB P02768 1/20 0.41
MAPK1 P28482 1/20 0.41
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.32
PYGM P11217 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL4501109 1.00 ALDH1A1 (0.41) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL1421772 0.85 LMNA (0.42) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL3953383 0.81 ALDH1A1 (0.39) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL9392057 0.81 ALDH1A1 (0.39) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL6632471 0.76 ABL1 (0.46) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL5013964 0.76 ABL1 (0.46) ALDH1A1LMNAALBMAPK1ABL1
SCHEMBL24695055 0.75 PYGM (0.53) ALDH1A1LMNAALBMAPK1PYGM
SCHEMBL10378942 0.75 PYGM (0.53) ALDH1A1LMNAALBMAPK1PYGM
SCHEMBL4749007 0.75 PYGM (0.53) ALDH1A1LMNAALBMAPK1PYGM
SCHEMBL23258398 0.73 LMNA (0.43) ALDH1A1LMNAALBMAPK1ABL1

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
US-7589077-B2 such as 5-iodo-O6-5'-cyclo-5,6-dihydro-3'-azido-3'-deoxythymidine for prophylaxis or diagnosis of viral diseases caused by hepatitis virus, herpes viruses such as Epstein-Barr virus Kumar, Rakesh (CA) 2009-09-15 US disclosed
US-20040242533-A1 Antiviral nucleosides KUMAR, RAKESH (CA) 2004-12-02 US disclosed
EP-1208091-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2002-05-29 EP disclosed
WO-2001017982-A1 BENZOPHENONES AS INHIBITORS OF REVERSE TRANSCRIPTASE GLAXO GROUP LIMITED (GB) 2001-03-15 WO disclosed
EP-0614357-A1 IMMUNOPOTENTIATORY AGENTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-09-14 EP disclosed
WO-1994007479-A2 IMMUNOPOTENTIATORY AGENTS THE WELLCOME FOUNDATION LIMITED (GB) 1994-04-14 WO 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-20040242533-A1 Antiviral nucleosides ENTPD5, DUT, ADA ALDH1A1 1901/4885LMNA 2597/4885ALB 4679/4885

“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.