SCHEMBL3073632

SCHEMBL3073632

NC(=S)NC1C2CC3CC(C2)CC1C3

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.67
SIGMAR1 Q99720 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.47
HSD17B10 Q99714 1/20 0.47
HSD11B1 P28845 2/20 0.44
KMT2A Q03164 1/20 0.42

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
SCHEMBL3069074 0.85 EPHX2 (0.72) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL3073976 0.80 EPHX2 (1.00) EPHX2L3MBTL1HSD17B10HSD11B1KMT2A
SCHEMBL11673733 0.77 EPHX2 (0.50) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL9115097 0.76 EPHX2 (0.54) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL3114854 0.76 L3MBTL1 (0.57) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL3070473 0.74 SIGMAR1 (0.60) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
Hydrochloric Acid SCHEMBL9115349 0.74 SIGMAR1 (0.55) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL2793556 0.71 EPHX2 (0.59) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL6154505 0.70 EPHX2 (0.58) EPHX2SIGMAR1L3MBTL1HSD17B10HSD11B1
SCHEMBL3069167 0.70 EPHX2 (0.70) EPHX2L3MBTL1HSD17B10HSD11B1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024190887-A1 DENTAL POLYMERIZATION KIT サンメディカル株式会社 2024-09-19 WO disclosed
WO-2024190888-A1 DENTAL POLYMERIZATION KIT サンメディカル株式会社 2024-09-19 WO disclosed
WO-2024075641-A1 POLYMER MATERIAL FOR USE IN DENTISTRY サンメディカル株式会社 2024-04-11 WO disclosed
WO-2022209944-A1 DENTAL POLYMERIZATION KIT サンメディカル株式会社 2022-10-06 WO disclosed
US-11325993-B2 Chemical polymerization initiator, adhesive composition, adhesive composition kit, dental material, dental material kit, and method of storing adhesive composition TOKUYAMA DENTAL CORPORATION 2022-05-10 US disclosed
CN-111295398-B Chemical polymerization initiator, adhesive composition, kit thereof, method for storing adhesive composition, dental material, and kit thereof 德山齿科株式会社 2022-04-26 CN disclosed
EP-3693400-B1 CHEMICAL POLYMERIZATION INITIATOR, ADHESIVE COMPOSITION, ADHESIVE COMPOSITION KIT, DENTAL MATERIAL, DENTAL MATERIAL KIT, AND METHOD FOR STORING ADHESIVE COMPOSITION TOKUYAMA DENTAL CORP (JP) 2021-10-06 EP disclosed
EP-3693400-A1 CHEMICAL POLYMERIZATION INITIATOR, ADHESIVE COMPOSITION, ADHESIVE COMPOSITION KIT, DENTAL MATERIAL, DENTAL MATERIAL KIT, AND METHOD FOR STORING ADHESIVE COMPOSITION Tokuyama Dental Corporation (JP) 2020-08-12 EP disclosed
US-20200239604-A1 CHEMICAL POLYMERIZATION INITIATOR, ADHESIVE COMPOSITION, ADHESIVE COMPOSITION KIT, DENTAL MATERIAL, DENTAL MATERIAL KIT, AND METHOD OF STORING ADHESIVE COMPOSITION TOKUYAMA DENTAL CORPORATION (JP) 2020-07-30 US disclosed
CN-111295398-A Chemical polymerization initiator, adhesive composition kit, dental material kit, and method for storing adhesive composition 德山齿科株式会社 2020-06-16 CN disclosed
US-20040104377-A1 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON 2004-06-03 US disclosed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 US disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
US-4211867-A ANTISECRETORY AGENTS, HYPOGLYCEMIC AGENTS, ANTIARRHYTHMIA AGENTS MCNEIL LABORATORIES, INCORPORATED (US) 1980-07-08 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-11325993-B2 Chemical polymerization initiator, adhesive composition, adhesive composition kit, dental material, dental material kit, and method of storing adhesive composition TPO, AOC1, TST EPHX2 110/4885SIGMAR1 1581/4885L3MBTL1 3998/4885
US-20200239604-A1 CHEMICAL POLYMERIZATION INITIATOR, ADHESIVE COMPOSITION, ADHESIVE COMPOSITION KIT, DENTAL MATERIAL, DENTAL MATERIAL KIT, AND METHOD OF STORING ADHESIVE COMPOSITION TPO, AOC1, TST EPHX2 110/4885SIGMAR1 1581/4885L3MBTL1 3998/4885

“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.