SCHEMBL4255288

SCHEMBL4255288

O=S(=O)(O)CC(O)c1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ADRB2 P07550 4/20 0.46
ADRB1 P08588 4/20 0.46
NAPRT Q6XQN6 1/20 0.46
CFTR P13569 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
GOPC Q9HD26 1/20 0.43
ADRB3 P13945 9/20 0.43
GAA P10253 1/20 0.41
CYP17A1 P05093 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL9682763 0.79 NAPRT (0.42) SMN1; SMN2LMNAL3MBTL1ADRB2ADRB1
SCHEMBL9226765 0.78 FDPS (0.45) SMN1; SMN2LMNAL3MBTL1NAPRTCFTR
SCHEMBL2488308 0.77 LMNA (0.50) SMN1; SMN2LMNAL3MBTL1
SCHEMBL7875002 0.77 LMNA (0.50) SMN1; SMN2LMNAL3MBTL1
SCHEMBL3087768 0.77 ADRB3 (0.47) SMN1; SMN2LMNAL3MBTL1ADRB2ADRB1
SCHEMBL5147826 0.77 SMN1; SMN2 (0.53) SMN1; SMN2LMNAL3MBTL1NAPRTCFTR
SCHEMBL25233552 0.76 SMN1; SMN2 (0.57) SMN1; SMN2LMNAL3MBTL1ADRB1CFTR
SCHEMBL4476838 0.76 SMN1; SMN2 (0.57) SMN1; SMN2LMNAL3MBTL1CFTRSLC6A2
SCHEMBL6075149 0.76 SMN1; SMN2 (0.57) SMN1; SMN2LMNAL3MBTL1CFTRSLC6A2
SCHEMBL6927013 0.76 SMN1; SMN2 (0.57) SMN1; SMN2LMNAL3MBTL1ADRB1CFTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1904471-B1 HETEROARYLETHENYL DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS HOFFMANN LA ROCHE (CH) 2009-10-21 EP disclosed
CN-101208325-A Heteroarylvinyl derivatives, their preparation and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2008-06-25 CN disclosed
EP-1904471-A1 HETEROARYLETHENYL DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-04-02 EP disclosed
US-7208506-B2 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. (US) 2007-04-24 US disclosed
WO-2007006459-A1 HETEROARYLETHENYL DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2007-01-18 WO disclosed
US-20070010564-A1 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. 2007-01-11 US disclosed
EP-0603557-B1 Catalyst compositions and catalytic processes PHILLIPS PETROLEUM CO (US) 1997-07-30 EP disclosed
US-5461126-A Process of polymerizing olefins using organonickel catalyst compositions PHILLIPS PETROLEUM COMPANY (US) 1995-10-24 US disclosed
US-5332708-A Ethylene polymerization catalyst, organonickel compound and a heterocyclic nitrogen compound PHILLIPS PETROLEUM COMPANY (US) 1994-07-26 US disclosed
EP-0603557-A1 Catalyst compositions and catalytic processes PHILLIPS PETROLEUM COMPANY (US) 1994-06-29 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 (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-20070010564-A1 Heteroarylethenyl derivatives, their manufacture and use as pharmaceutical agents CYP3A43, CYP1A1, CYP3A5 SMN1; SMN2 4219/4885LMNA 2115/4885L3MBTL1 999/4885

“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.