SCHEMBL6993726

SCHEMBL6993726

CCCCSC(CC)CO

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
EPHX1 P07099 1/20 0.35
LMNA P02545 3/20 0.34
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL18837636 0.91 EPHX1 (0.46) ALDH1A1EPHX1LMNASMN1; SMN2HSD17B10
SCHEMBL18837599 0.91 EPHX1 (0.46) ALDH1A1EPHX1LMNASMN1; SMN2HSD17B10
SCHEMBL18837643 0.91 EPHX1 (0.46) ALDH1A1EPHX1LMNASMN1; SMN2HSD17B10
SCHEMBL18837634 0.91 EPHX1 (0.46) ALDH1A1EPHX1LMNASMN1; SMN2HSD17B10
SCHEMBL7003861 0.85
SCHEMBL9798469 0.83 EPHX1 (0.45) ALDH1A1EPHX1LMNASMN1; SMN2HSD17B10
SCHEMBL11361819 0.82 EPHX1 (0.33) ALDH1A1EPHX1LMNANOS3NOS1
SCHEMBL2252378 0.81 EPHX1 (0.31) EPHX1
SCHEMBL10628579 0.77 EPHX1 (0.43) EPHX1LMNASMN1; SMN2HSD17B10TSHR
SCHEMBL15725508 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11053449-B2 Thioether-containing phenolic compounds THE LUBRIZOL CORPORATION (US) 2021-07-06 US disclosed
EP-3374478-B1 LUBRICATING COMPOSITION COMPRISING THIOETHER-SUBSTITUTED PHENOLIC COMPOUND LUBRIZOL CORP (US) 2021-01-06 EP disclosed
US-20200239805-A1 THIOETHER-CONTAINING PHENOLIC COMPOUNDS THE LUBRIZOL CORPORATION 2020-07-30 US disclosed
EP-3374478-A1 LUBRICATING COMPOSITION COMPRISING THIOETHER-SUBSTITUTED PHENOLIC COMPOUND The Lubrizol Corporation (US) 2018-09-19 EP disclosed
CN-108473899-A Lubricating composition containing thioether-substituted phenol compound 路博润公司 2018-08-31 CN disclosed
WO-2017083243-A1 LUBRICATING COMPOSITION COMPRISING THIOETHER-SUBSTITUTED PHENOLIC COMPOUND THE LUBRIZOL CORPORATION (US) 2017-05-18 WO disclosed
US-6525000-B1 N-aminoureas are reacted with formaldehyde to give methyleneimino ureas, cyclizing these to give tetrahydro-4H-1,3,4-oxa(or thia)diazines, and cyclizing the fused triazoles using phosgene; herbicides BASF AKTIENGESELLSCHAFT (DE) 2003-02-25 US disclosed
EP-1095045-B1 METHOD FOR PRODUCING ANELLATED TRIAZOLES AND NEW ANELLATED TRIAZOLES AND THEIR USE BASF AG (DE) 2003-01-15 EP disclosed
EP-0835248-B1 1-AMINO-3-BENZYLURACILS BASF AG (DE) 2001-02-21 EP disclosed
EP-0971904-A1 NOVEL 1-AMINO-3 BENZYL URACILS BASF AKTIENGESELLSCHAFT (DE) 2000-01-19 EP disclosed
WO-1998042682-A1 NOVEL 1-AMINO-3 BENZYL URACILS BASF AKTIENGESELLSCHAFT (DE) 1998-10-01 WO disclosed
EP-0835248-A1 1-AMINO-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1998-04-15 EP disclosed
WO-1997001543-A1 1-AMINO-3-BENZYLURACILS BASF AKTIENGESELLSCHAFT (DE) 1997-01-16 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-11053449-B2 Thioether-containing phenolic compounds TST, TH, COMT ALDH1A1 192/4885EPHX1 628/4885LMNA 4850/4885
US-20200239805-A1 THIOETHER-CONTAINING PHENOLIC COMPOUNDS TST, TH, COMT ALDH1A1 192/4885EPHX1 628/4885LMNA 4850/4885

“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.