SCHEMBL5126741

SCHEMBL5126741

O=S(=O)(O)c1ccc(F)c(S(=O)(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
HSD17B10 Q99714 4/20 0.44
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CASP6 P55212 1/20 0.43
PKM P14618 1/20 0.42
TSHR P16473 3/20 0.41
NT5E P21589 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
TIMP3 P35625 1/20 0.41
CASR P41180 1/20 0.40
TET2 Q6N021 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
PARP1 P09874 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL249875 0.89 VCAM1 (0.48) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL30475007 0.89 VCAM1 (0.48) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL7623197 0.89 VCAM1 (0.48) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL6007987 0.89 VCAM1 (0.48) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL25203443 0.88 VCAM1 (0.47) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL4581128 0.88 VCAM1 (0.47) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL3097348 0.88 VCAM1 (0.47) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL15199477 0.88 TET2 (0.38) ALDH1A1HSD17B10LMNACYP2C9CYP2C19
SCHEMBL28707093 0.88 VCAM1 (0.47) ALDH1A1LMNAPKMTSHRNT5E
SCHEMBL19021731 0.84 VCAM1 (0.44) TDP1TET2VCAM1

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1646467-A Process for making butenyl esters from butadiene UNIV SOUTHERN MISSISSIPPI (US) 2005-07-27 CN claimed
US-20050065365-A1 Process for making esters from butadiene THE UNIV. OF SOUTHERN MISS. RESEARCH FOUNDATION (US) 2005-03-24 US claimed
EP-1490321-A1 PROCESS FOR MAKING BUTENYL ESTERS FROM BUTADIENE THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2004-12-29 EP claimed
WO-2003082796-A1 PROCESS FOR MAKING BUTENYL ESTERS FROM BUTADIENE THE UNIVERSITY OF SOUTHERN MISSISSIPPI RESEARCH FOUNDATION (US) 2003-10-09 WO claimed
EP-0638578-B1 Secondary and tertiary phosphanes and process for their preparation CELANESE GMBH (DE) 1999-09-01 EP claimed
US-5925785-A Secondary and tertiary phosphines and processes for their preparation CELANESE GMBH (DE) 1999-07-20 US claimed
EP-0638578-A1 Secondary and primary phosphanes and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-02-15 EP claimed
US-4820831-A Process for preparing 4,4'-dihydroxydiphenyl sulfone having high purity KONISHI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-04-11 US claimed
JP-7145184-A None JP disclosed
JP-58183640-A None JP disclosed
US-7456321-B2 Process for producing high-purity 4,4′-dihydroxydiphenyl sulfone KONISHI CHEMICAL IND. CO., LTD. (JP) 2008-11-25 US disclosed
CN-1314664-C Process for producing high-purity 4,4'-dihydroxydiphenyl sulfone KONISHI CHEM IND (JP) 2007-05-09 CN disclosed
US-20070060769-A1 Integrated process to produce derivatives of butadiene addition products THE UNIVERSITY OF SOUTHERN MISSISSIPPI RESEARCH FOUNDATION (US) 2007-03-15 US disclosed
CN-1805919-A Integrated process to produce derivatives of butadiene addition products UNIV SOUTHERN MISSISSIPPI RES (US) 2006-07-19 CN disclosed
EP-0443046-B1 PROCESS FOR PREPARING 4,4'-DIHYDROXYDIPHENYL SULFONE KONISHI CHEM IND (JP) 1994-04-13 EP disclosed
US-5189223-A PROCESS FOR PREPARATION OF 4,4'-DIHYDROXYDIPHENYLSULFONE KONISHI CHEMICAL IND. CO., LTD. (JP) 1993-02-23 US disclosed
EP-0443046-A1 PROCESS FOR PREPARING 4,4'-DIHYDROXYDIPHENYL SULFONE KONISHI CHEMICAL IND. CO., LTD. (JP) 1991-08-28 EP disclosed
US-4820831-A Process for preparing 4,4'-dihydroxydiphenyl sulfone having high purity KONISHI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-04-11 US disclosed
JP-S58183640-A PRODUCTION OF ACETIC ESTER NIPPON SYNTHETIC CHEM IND CO LTD:THE 1983-10-26 JP disclosed
US-4405808-A FROM ACETIC ACID AND OLEFIN IN PRESENCE OF STEAM AND AROMATIC DISULFONIC ACID CATALYST NIPPON GOHSEI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1983-09-20 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-20070060769-A1 Integrated process to produce derivatives of butadiene addition products ADH5, ADH1C, ADH1A ALDH1A1 192/4885HSD17B10 22/4885LMNA 1613/4885
US-20050065365-A1 Process for making esters from butadiene SQLE, SCD, FASN ALDH1A1 447/4885HSD17B10 10/4885LMNA 4675/4885

“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.