SCHEMBL4661735

SCHEMBL4661735

CCCCCCCCCOc1cc(O)c(C(=O)c2ccccc2)cc1S(=O)(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.67
MAPT P10636 3/20 0.67
KMT2A Q03164 2/20 0.67
ALDH1A1 P00352 1/20 0.67
NR1H4 Q96RI1 1/20 0.52
S1PR3 Q99500 1/20 0.50
CYP3A4 P08684 2/20 0.48
HPGD P15428 2/20 0.48
KDM4E B2RXH2 1/20 0.48
RECQL P46063 1/20 0.48
HSD17B10 Q99714 1/20 0.48
PTPN11 Q06124 3/20 0.46
MEN1 O00255 1/20 0.44
NR1I2 O75469 1/20 0.44
CHRM2 P08172 1/20 0.44
ADRA2A P08913 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HDAC6 Q9UBN7 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
SCHEMBL4660278 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4661746 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4662829 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4660309 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4661584 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4661617 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4661658 1.00 LMNA (0.67) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4660398 0.99 LMNA (0.68) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4660272 0.95 LMNA (0.70) LMNAMAPTKMT2AALDH1A1NR1H4
SCHEMBL4661580 0.92 LMNA (0.71) LMNAMAPTKMT2AALDH1A1NR1H4

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-1427697-B1 SULPHONATION OF PHENOLS GREAT LAKES CHEMICAL EUROP (CH) 2008-12-24 EP disclosed
US-6936732-B2 Sulphonation of phenols ADDIVANT USA, LLC 2005-08-30 US disclosed
US-20050054876-A1 Sulphonation of phenols ADDIVANT USA, LLC 2005-03-10 US disclosed
EP-1427697-A1 SULPHONATION OF PHENOLS Great Lakes Chemical (Europe) GmbH (CH) 2004-06-16 EP disclosed
WO-2003027063-A1 SULPHONATION OF PHENOLS GREAT LAKES CHEMICAL (EUROPE) GMBH (CH) 2003-04-03 WO disclosed
EP-0351615-B1 PROCESS FOR THE PREPARATION OF 4-ALKOXY-2-HYDROXYBENZOPHENONE-5-SULFONIC ACIDS BASF Aktiengesellschaft (DE) 1992-10-28 EP disclosed
US-5072034-A PREPARATION OF 4-ALKOXY-2-HYDROXYBENZOPHENONE-5-SULFONIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1991-12-10 US disclosed
EP-0351615-A1 Process for the preparation of 4-alkoxy-2-hydroxybenzophenone-5-sulfonic acids BASF Aktiengesellschaft (DE) 1990-01-24 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-20050054876-A1 Sulphonation of phenols CBR3, C1S, C1R LMNA 3440/4885MAPT 4859/4885KMT2A 3243/4885

“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.