SCHEMBL4875722

SCHEMBL4875722

OC[C@H]1O[C@@H](Nc2ncccn2)[C@H](O)[C@@H]1O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
TSHR P16473 1/20 0.47
ADK P55263 1/20 0.46
CA1 P00915 6/20 0.46
CA2 P00918 6/20 0.46
MAPT P10636 1/20 0.46
CDA P32320 1/20 0.46
SLC5A2 P31639 1/20 0.44
PYGB P11216 1/20 0.44

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
SCHEMBL15955793 1.00 NPC1 (0.49) NPC1RAB9ATSHRADKCA1
SCHEMBL769262 0.80 ADORA1 (0.45) MAPTCDA
SCHEMBL14403360 0.78 ADK (0.51) NPC1RAB9ATSHRADKCA1
SCHEMBL12171751 0.78 ADK (0.51) NPC1RAB9ATSHRADKCA1
SCHEMBL25084035 0.77 IGF2R (0.41) NPC1RAB9ATSHRCA1CA2
SCHEMBL4901149 0.77 ADK (0.56) TSHRADKCA1CA2
SCHEMBL7905414 0.75 TSHR (0.59) NPC1RAB9ATSHRADKCA1
SCHEMBL5063261 0.75 TSHR (0.43) NPC1RAB9ATSHRADKCA1
SCHEMBL4875548 0.75 ADK (0.43) NPC1RAB9ATSHRADKCA1
SCHEMBL7151149 0.75 NPC1 (0.74) NPC1RAB9ATSHRCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449570-B2 Use of nucleoside compounds for nonsense suppression and the treatment of genetic diseases PTC THERAPEUTICS, INC. (US) 2008-11-11 US disclosed
US-20080090774-A1 Nucleoside compounds and their use for treating cancer and diseases associated with somatic mutations PTC THERAPEUTICS, INC. 2008-04-17 US disclosed
US-7291603-B2 Nucleoside compounds and their use for treating cancer and diseases associated with somatic mutations PTC THERAPEUTICS, INC. (US) 2007-11-06 US disclosed
US-20060166926-A1 Use of nucleoside compounds for nonsense suppression and the treatment of genetic diseases PTC THERAPEUTICS, INC. 2006-07-27 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 (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-20060166926-A1 Use of nucleoside compounds for nonsense suppression and the treatment of genetic diseases NSUN2, UPF1, NSUN3 NPC1 333/4885RAB9A 2042/4885TSHR 3690/4885
US-20080090774-A1 Nucleoside compounds and their use for treating cancer and diseases associated with somatic mutations NSUN2, RNMT, NSUN3 NPC1 257/4885RAB9A 2040/4885TSHR 4328/4885

“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.