SCHEMBL6629256

SCHEMBL6629256

COCCOc1ccc(S(C)(=O)=O)cc1C(=O)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.47
TSHR P16473 3/20 0.47
CYP2C9 P11712 2/20 0.47
ADRA2A P08913 1/20 0.47
CYP2D6 P10635 1/20 0.47
DRD2 P14416 1/20 0.47
DRD3 P35462 1/20 0.47
HTR2B P41595 1/20 0.47
STAT6 P42226 1/20 0.47
KCNH2 Q12809 1/20 0.47
BLM P54132 1/20 0.46
GAA P10253 2/20 0.44
S1PR3 Q99500 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HSP90AA1 P07900 2/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL6628554 0.89 S1PR3 (0.49) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL6630509 0.88 S1PR3 (0.54) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL4421524 0.87 S1PR3 (0.56) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL6628635 0.86 HTT (0.52) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL4418726 0.84 SLC6A9 (0.54) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL6630760 0.82 SLC6A9 (0.49) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL3220624 0.82 SMN1; SMN2 (0.57) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL385093 0.80 MAPT (0.51) CYP2C9CYP2D6SMN1; SMN2HSP90AA1MAPT
SCHEMBL4422116 0.79 EPAS1 (0.43) LMNATSHRCYP2C9ADRA2ACYP2D6
SCHEMBL13392322 0.78 ALDH1A1 (0.45) CYP2C9SMN1; SMN2HSP90AA1MAPTALDH1A1

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
EP-1368352-B1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS PFIZER LTD (GB) 2004-12-01 EP claimed
US-6770645-B2 SEXUAL DISORDERS THERAPY; ANTIALLERGENS; RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2004-08-03 US claimed
US-20030064990-A1 Pharmaceutically active compounds PFIZER INC. 2003-04-03 US claimed
EP-1368352-B1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS PFIZER LTD (GB) 2004-12-01 EP disclosed
US-6770645-B2 SEXUAL DISORDERS THERAPY; ANTIALLERGENS; RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2004-08-03 US disclosed
EP-1368352-A1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS Pfizer Limited (GB) 2003-12-10 EP disclosed
US-20030064990-A1 Pharmaceutically active compounds PFIZER INC. 2003-04-03 US disclosed
WO-2002074774-A1 CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS PFIZER LIMITED (GB) 2002-09-26 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-20030064990-A1 Pharmaceutically active compounds PDE5A, PDE3A, PDE2A LMNA 2151/4885TSHR 2374/4885CYP2C9 748/4885

“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.