SCHEMBL7672006

SCHEMBL7672006

O=S(=O)(c1ccccc1)c1ncc(C(F)(F)F)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 1.00
LMNA P02545 4/20 1.00
HTT P42858 4/20 1.00
MAPT P10636 2/20 1.00
KDM4E B2RXH2 1/20 0.70
KMT2A Q03164 5/20 0.61
TRPM8 Q7Z2W7 4/20 0.54
HPGD P15428 2/20 0.51
GLA P06280 1/20 0.51
MEN1 O00255 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
XBP1 P17861 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD11B1 P28845 1/20 0.47
POLB P06746 1/20 0.47
USP2 O75604 1/20 0.47
GAA P10253 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.46

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
SCHEMBL7676030 0.84 ALDH1A1 (0.72) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL6466443 0.78 ALDH1A1 (0.63) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL30567082 0.78 ALDH1A1 (0.63) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL25374549 0.78 ALDH1A1 (0.63) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL5592136 0.78 ALDH1A1 (0.63) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL8431899 0.76 ALDH1A1 (0.61) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL5819225 0.76 ALDH1A1 (0.61) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL21800166 0.76 ALDH1A1 (0.61) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL119177 0.76 KMT2A (0.77) ALDH1A1LMNAHTTMAPTKDM4E
SCHEMBL8431893 0.75 ALDH1A1 (0.60) ALDH1A1LMNAHTTMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407245-B2 HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2002-06-18 US disclosed
US-20010012897-A1 Substituted thiopyridines HAMPRECHT GERHARD (DE) 2001-08-09 US disclosed
US-6262273-B1 REACTING A3-CHLORO-2-HALOPYRIDINE WITH THIO COMPOUND IN PRESENCE OF TRIFLUOROACETIC ACID OR PERCHLORIC ACID TO GIVE PYRIDINE THIOETHER COMPOUND WHICH IS OXIDIZED TO GIVE THIOPYRIDINE COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2001-07-17 US disclosed
US-6191280-B1 REACTING SUBSTITUTED 2-HALOPYRIDINE DERIVATIVE WITH A THIO COMPOUND IN PRESENCE OF COPPER CATALYST TO GIVE A PYRIDINE THIOETHER, AND THEN OXIDIZING THE THIOETHER INTERMEDIATE TO FORM SULFOXIDE OR SULFONE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 2001-02-20 US disclosed
US-6169184-B1 REACTING SUBSTITUTED PYRIDINE WITH SPECIFIED ARYL COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2001-01-02 US disclosed
EP-0984935-A1 METHOD FOR PRODUCING SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP disclosed
EP-0934275-A1 SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1999-08-11 EP disclosed
EP-0931068-A1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED PHENYLPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1999-07-28 EP disclosed
WO-1998054139-A1 METHOD FOR PRODUCING SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1998-12-03 WO disclosed
WO-1998011072-A1 SUBSTITUTED THIOPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1998-03-19 WO disclosed
WO-1998011069-A1 PROCESS FOR THE PRODUCTION OF SUBSTITUTED PHENYLPYRIDINES BASF AKTIENGESELLSCHAFT (DE) 1998-03-19 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-20010012897-A1 Substituted thiopyridines CBR1, CLIC1, CBR3 ALDH1A1 294/4885LMNA 1928/4885HTT 3789/4885

“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.