SCHEMBL6293376

SCHEMBL6293376

CC(=O)O[C@H](C)c1nccc(=O)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.39
PDE3A Q14432 3/20 0.39
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP12 P39900 1/20 0.37
GAA P10253 1/20 0.36
GPR84 Q9NQS5 1/20 0.34
TSHR P16473 2/20 0.34
CASP1 P29466 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 3/20 0.33
MAPT P10636 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
GLA P06280 1/20 0.33
LMNA P02545 1/20 0.33
GCK P35557 1/20 0.33
APEX1 P27695 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL6293377 1.00 PDE3B (0.39) PDE3BPDE3AMMP1MMP2MMP9
SCHEMBL6297952 0.81 GPR84 (0.39) PDE3BPDE3AMMP1MMP2MMP9
SCHEMBL6587174 0.75 PDE3B (0.42) PDE3BPDE3AGAAGPR84POLB
Hydrochloric Acid SCHEMBL6293152 0.74 PDE3B (0.41) PDE3BPDE3AGAAGPR84POLB
Hydrochloric Acid SCHEMBL6293153 0.74 PDE3B (0.41) PDE3BPDE3AGAAGPR84POLB
SCHEMBL7378795 0.74 PDE3B (0.57) PDE3BPDE3AHSD17B10ALDH1A1
SCHEMBL22275400 0.72 PDE3B (0.39) PDE3BPDE3AGPR84ALDH1A1POLB
SCHEMBL510091 0.66 PDE3B (0.50) PDE3BPDE3AGAAGPR84ALDH1A1
SCHEMBL9737863 0.66 TSHR (0.41) MMP12TSHRALDH1A1POLBMAPT
SCHEMBL21742338 0.66 TSHR (0.54) GAATSHRALDH1A1LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936600-B2 Sorbitol dehrydrogenase inhibitors PFIZER INC (US) 2005-08-30 US disclosed
US-6869943-B2 Sorbitol dehydrogenase inhibitors PFIZER INC (US) 2005-03-22 US disclosed
US-20050020578-A1 Sorbitol dehydrogenase inhibitors PFIZER INC. 2005-01-27 US disclosed
US-20040077671-A1 Sorbitol dehydrogenase inhibitors CHU-MOYER MARGARET Y (US) 2004-04-22 US disclosed
US-6660740-B1 Sorbitol dehydrogenase inhibitors PFIZER INC 2003-12-09 US disclosed
US-6414149-B1 TREATING DIABETES, TREATING OR PREVENTING DIABETIC COMPLICATIONS PFIZER INC. 2002-07-02 US disclosed
EP-1185275-A1 AMINOPYRIMIDINES AS SORBITOL DEHYDROGENASE INHIBITORS Pfizer Products Inc. (US) 2002-03-13 EP disclosed
WO-2000059510-A1 AMINOPYRIMIDINES AS SORBITOL DEHYDROGENASE INHIBITORS PFIZER PRODUCTS INC. (US) 2000-10-12 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 (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-20050020578-A1 Sorbitol dehydrogenase inhibitors SLC5A1, SORD, SLC5A2 PDE3B 605/4885PDE3A 765/4885MMP1 673/4885
US-20040077671-A1 Sorbitol dehydrogenase inhibitors SLC5A1, SORD, SLC5A2 PDE3B 606/4885PDE3A 656/4885MMP1 660/4885

“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.