SCHEMBL230830

SCHEMBL230830

CCC(C(C)=O)C(=O)O.[Ti]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.38
CHRM1 P11229 1/20 0.38
AKR1A1 P14550 1/20 0.38
CHRM3 P20309 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.37
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
FFAR3 O14843 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.33

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
SCHEMBL124998 1.00 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL767059 1.00 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL5683149 0.97 TDP1 (0.36) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL157028 0.97
SCHEMBL9153552 0.94 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL21519882 0.94 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL21219177 0.94 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL21225948 0.94 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL487120 0.94 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A
SCHEMBL487333 0.94 TDP1 (0.38) TDP1CHRM1AKR1A1CHRM3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250262347-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF SMITH & NEPHEW INC (US) 2025-08-21 US claimed
US-12345171-B2 Protective coatings for aircraft engine components GE AVIO S.R.L. (IT) 2025-07-01 US claimed
US-20250093793-A1 TONER CANON KABUSHIKI KAISHA (JP) 2025-03-20 US claimed
EP-4511077-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF Smith&Nephew, Inc. (US) 2025-02-26 EP claimed
US-20250034316-A1 CURABLE COMPOSITION, CURED PRODUCT AND CURING CATALYST FOR BLOCKED ISOCYANATE COMPOUND KOEI CHEMICAL COMPANY, LIMITED (JP) 2025-01-30 US claimed
CN-117976834-A Potassium ion battery anode material and preparation method and application thereof 溧阳天目先导电池材料科技有限公司 2024-05-03 CN claimed
CN-116254092-B Organic silicon liquid packaging adhesive and preparation method thereof 湖北兴瑞硅材料有限公司 2024-04-19 CN claimed
WO-2023205141-A1 BONE REPAIR COMPOSITIONS COMPRISING POLYTHIOURETHANE AND USES THEREOF SMITH & NEPHEW, INC. (US) 2023-10-26 WO claimed
CN-116254092-A Organic silicon liquid packaging adhesive and preparation method thereof 湖北兴瑞硅材料有限公司 2023-06-13 CN claimed
US-20230121607-A1 PROTECTIVE COATINGS FOR AIRCRAFT ENGINE COMPONENTS GE AVIO S.R.L. (IT) 2023-04-20 US claimed
US-5642783-A MIXTURE OF CARBOXYLATE-CONTAINING POLYMER AND TITANIUM, ALUMINUM, IRON OR ZIRCONIUM-COMPOUNDS AS COSSLINKING AGENTS IN A LIQUID IS INJECTED INTO UNDERGROUND FORMATION TO GEL AND PROMOTE OIL RECOVERY PHILLIPS PETROLEUM COMPANY (US) 1997-07-01 US claimed
WO-1997022638-A1 COMPOSITIONS AND PROCESSES FOR TREATING SUBTERRANEAN FORMATIONS PHILLIPS PETROLEUM COMPANY (US) 1997-06-26 WO claimed
US-5547025-A INJECTING A GELLING COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1996-08-20 US claimed
US-5478802-A Injecting a solution of brine, a water-soluble polymer, a complexing ligand and a crosslinker PHILLIPS PETROLEUM COMPANY (US) 1995-12-26 US claimed
EP-0668432-A2 Process for treating oil-bearing formation PHILLIPS PETROLEUM COMPANY (US) 1995-08-23 EP claimed
US-5423380-A Adding crosslinking agent intermittently to stream of aqueous solution of gellable polymer injected into subterranean formation PHILLIPS PETROLEUM COMPANY (US) 1995-06-13 US claimed
EP-0604988-A2 Gelling compositions useful for oil field applications PHILLIPS PETROLEUM COMPANY (US) 1994-07-06 EP claimed
US-4560716-A Rust preventing epoxy resin compositions KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 1985-12-24 US claimed
US-4552907-A LANOLIN, CORROSION RESISTANCE KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 1985-11-12 US claimed
US-4447659-A TITANIUM CATALYSTS NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) 1984-05-08 US claimed

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-20250034316-A1 CURABLE COMPOSITION, CURED PRODUCT AND CURING CATALYST FOR BLOCKED ISOCYANATE COMPOUND C5, KDM2B, KDM6B TDP1 3525/4885CHRM1 145/4885AKR1A1 2707/4885

“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.