SCHEMBL345544

SCHEMBL345544

C=C(C)C(=O)OCCCCCCCCCCOP(=O)(O)OP(=O)(O)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
BTN3A1 O00481 3/20 0.54
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
THRB P10828 1/20 0.41
MVD P53602 2/20 0.41
LPAR3 Q9UBY5 5/20 0.40
LPAR2 Q9HBW0 3/20 0.40
LPAR1 Q92633 3/20 0.40
GGPS1 O95749 2/20 0.38
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36

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
SCHEMBL3447167 1.00 TSHR (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL19205471 1.00 TSHR (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL3446942 1.00 TSHR (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL19205476 1.00 TSHR (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL3448299 1.00 TSHR (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL19205441 1.00 TSHR (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL3447223 0.98 BTN3A1 (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL19205437 0.95 BTN3A1 (0.56) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL1173708 0.94 TSHR (0.59) TSHRBTN3A1POLBAPEX1HTT
SCHEMBL374520 0.94 TSHR (0.59) TSHRBTN3A1POLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110302062-B Dental adhesive glass ion water-gate composition with good removability 株式会社松风 2024-06-07 CN disclosed
US-20240173211-A1 DENTAL RESIN-REINFORCED GLASS IONOMER CEMENT KIT SHOFU INC. (JP) 2024-05-30 US disclosed
CN-118043020-A Dental adhesive composition 株式会社GC 2024-05-14 CN disclosed
CN-117979939-A Method for producing dental filling material, and dental composition 株式会社GC 2024-05-03 CN disclosed
CN-111743783-B Double-paste type dental resin reinforced glass ion water-gate composition 株式会社松风 2024-04-16 CN disclosed
EP-4321145-A1 DENTAL RESIN-REINFORCED GLASS IONOMER CEMENT KIT Shofu Inc. (JP) 2024-02-14 EP disclosed
CN-117357405-A Dental adhesive glass ion water-gate composition with good removability 株式会社松风 2024-01-09 CN disclosed
CN-113440418-B Dental polymerizable composition 株式会社GC 2023-12-26 CN disclosed
CN-117083047-A Dental polymerizable composition 株式会社GC 2023-11-17 CN disclosed
CN-116829116-A Dental adhesive composition 株式会社GC 2023-09-29 CN disclosed
EP-3552596-A2 SS IONOMER CEMENT COMPOSITION FOR DENTAL LUTING CEMENTS Shofu Inc. (JP) 2019-10-16 EP disclosed
US-10307344-B2 Two-paste type sealer composition for root canal filling SHOFU INC. (JP) 2019-06-04 US disclosed
US-20170231873-A1 TWO-PASTE TYPE SEALER COMPOSITION FOR ROOT CANAL FILLING SHOFU INC. (JP) 2017-08-17 US disclosed
US-20170231874-A1 SEALER COMPOSITION FOR ROOT CANAL FILLING SHOFU INC. (JP) 2017-08-17 US disclosed
EP-3205326-A1 TWO-PASTE TYPE SEALER COMPOSITION FOR ROOT CANAL FILLING Shofu Inc. (JP) 2017-08-16 EP disclosed
EP-3205327-A1 SEALER COMPOSITION FOR ROOT CANAL FILLING Shofu Inc. (JP) 2017-08-16 EP disclosed
CN-105611994-A Composite semipermeable membrane and method for manufacturing same TORAY INDUSTRIES 2016-05-25 CN disclosed
US-8545225-B2 Redox-curing type composition KURARAY NORITAKE DENTAL INC. (JP) 2013-10-01 US disclosed
US-20120016094-A1 REDOX-CURING TYPE COMPOSITION KURARAY MEDICAL INC. (JP) 2012-01-19 US disclosed
WO-2010033515-A1 SINGLE-CONTAINER DENTAL ADHESIVE DANVILLE MATERIALS, INC. (US) 2010-03-25 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-20240173211-A1 DENTAL RESIN-REINFORCED GLASS IONOMER CEMENT KIT GRIK1, GRIN2B, GRIK2 TSHR 2655/4885BTN3A1 3550/4885POLB 1327/4885

“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.