SCHEMBL587358

SCHEMBL587358

CCCCn1ccn(C)c1=S

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPO P22079 4/20 0.50
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
TLR8 Q9NR97 2/20 0.36
GAA P10253 1/20 0.35
MEN1 O00255 1/20 0.33
TYR P14679 1/20 0.33
CNR2 P34972 2/20 0.33
ADORA2A P29274 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL12122682 0.92 LPO (0.46) LPOKMT2AALDH1A1POLBLMNA
SCHEMBL972632 0.92 LPO (0.46) LPOKMT2AALDH1A1POLBLMNA
SCHEMBL12122681 0.92 LPO (0.46) LPOKMT2AALDH1A1POLBLMNA
SCHEMBL972118 0.86 LPO (0.55) LPOKMT2AALDH1A1LMNACYP1A2
SCHEMBL2514962 0.82 TLR8 (0.47) LPOKMT2AALDH1A1POLBLMNA
SCHEMBL8146236 0.80 TLR8 (0.46) KMT2AALDH1A1POLBLMNACYP1A2
SCHEMBL587606 0.79
SCHEMBL22504083 0.77 TLR8 (0.43) KMT2AALDH1A1POLBLMNACYP1A2
SCHEMBL19303315 0.75 TLR8 (0.42) LPOKMT2AALDH1A1POLBLMNA
SCHEMBL24885966 0.74 ALDH1A1 (0.42) KMT2AALDH1A1POLBLMNATLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411927-B1 Coating compositions containing 1,3-dialkylimidazole-2-thione catalysts DU PONT (US) 1995-01-18 EP claimed
US-5091498-A Alkali resistant coatings E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-02-25 US claimed
EP-0411927-A1 Coating compositions containing 1,3-dialkylimidazole-2-thione catalysts E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-02-06 EP claimed
JP-3137118-A None JP disclosed
US-9751841-B2 Process for the preparation of chalcogene compounds PETROLIAM NASIONAL BERHAD (MY) 2017-09-05 US disclosed
EP-2417109-B1 PROCESS FOR THE PREPARATION OF CHALCOGENE COMPOUNDS PETROLIAM NASIONAL BERHAD PETRONAS (MY) 2014-12-03 EP disclosed
US-20120108822-A1 Process For The Preparation Of Chalcogene Compounds PETROLIAM NASIONAL BERHAD (MY) 2012-05-03 US disclosed
EP-2417109-A2 PROCESS FOR THE PREPARATION OF CHALCOGENE COMPOUNDS Petroliam Nasional Berhad (MY) 2012-02-15 EP disclosed
US-8057780-B2 Method for preparing nanoparticles using carbene derivatives SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-11-15 US disclosed
US-8057780-B2 Method for preparing nanoparticles using carbene derivatives SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-11-15 US disclosed
US-7868182-B2 Solventless one-step process for the production of imidazole-2-thiones ARDUENGO III ANTHONY J 2011-01-11 US disclosed
US-5189160-A For preparing high molecular weight aramids by ring opening polymerization E. I. DU PONT DE NEMOURS AND COMPANY (US) 1993-02-23 US disclosed
WO-1992019665-A1 CYCLIC AROMATIC AMIDE OLIGOMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-11-12 WO disclosed
US-5162482-A 1,3-dialkylimidazole-2-thione catalysts and method of making same E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-11-10 US disclosed
US-5104993-A Reacting 1-alkylimidazole and alkyl halide; contacting product with a suspension of sulfur and an alkali metal alkoxide E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-14 US disclosed
US-5091498-A Alkali resistant coatings E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-02-25 US disclosed
US-5084542-A Clear colorless resistant coatings with improved weatherability E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-01-28 US disclosed
WO-1991018937-A1 EPOXY/ISOCYANATE CROSSLINKED COATINGS CONTAINING 1,3-DISUBSTITUTED IMIDAZOLE-2-THIONE CATALYSTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-12-12 WO disclosed
JP-H03137118-A COATING COMPOSITION CONTAINING 1,3-DIALKYLIMIDAZOL-2-THIONE CATALYST E I DU PONT DE NEMOURS & CO 1991-06-11 JP disclosed
EP-0411927-A1 Coating compositions containing 1,3-dialkylimidazole-2-thione catalysts E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-02-06 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-20120108822-A1 Process For The Preparation Of Chalcogene Compounds SCO2, NISCH, AQP1 LPO 2135/4885KMT2A 2912/4885ALDH1A1 4011/4885

“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.