SCHEMBL108345

SCHEMBL108345

CCCCC(CC)Cc1c(CC(CC)CCCC)c(C(=O)O)c(C(=O)O)c(CC(CC)CCCC)c1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
CYP3A4 P08684 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
ATM Q13315 1/20 0.44
CA2 P00918 5/20 0.43
ALDH1A1 P00352 7/20 0.42
MAPK1 P28482 3/20 0.40
CA1 P00915 1/20 0.39
LMNA P02545 3/20 0.38
HSD17B10 Q99714 1/20 0.38
GLA P06280 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RECQL P46063 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37

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
SCHEMBL29523183 1.00 TSHR (0.44) TSHRCYP3A4TDP1ATMCA2
Acetone SCHEMBL10535239 0.97 TSHR (0.41) TSHRCYP3A4TDP1ATMCA2
SCHEMBL7878129 0.96 CA2 (0.46) TSHRCYP3A4TDP1ATMCA2
SCHEMBL8959367 0.96 CA2 (0.46) TSHRCYP3A4TDP1ATMCA2
SCHEMBL14989251 0.93 CA2 (0.44) TSHRCYP3A4TDP1ATMCA2
SCHEMBL23646642 0.91 CA2 (0.42) TSHRCYP3A4TDP1ATMCA2
SCHEMBL10774869 0.90 CA2 (0.39) TSHRCYP3A4TDP1ATMCA2
Benzoic Acid SCHEMBL15918863 0.89 ALDH1A1 (0.47) TSHRCYP3A4CA2ALDH1A1MAPK1
SCHEMBL25280291 0.87 ALDH1A1 (0.55) TSHRCYP3A4TDP1ATMCA2
SCHEMBL16965873 0.85 POLB (0.33) HTT

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 1101 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739724-A1 MULTI-COMPONENT RESIN SYSTEM COMPRISING AT LEAST ONE PLASTICISER, MORTAR COMPOSITION BASED ON ISOCYANATE-AMINE ADDUCTS, AND METHOD AND USE OF THE MULTI-COMPONENT RESIN SYSTEM FOR FASTENING CONSTRUCTION ELEMENTS Hilti Aktiengesellschaft (LI) 2026-05-13 EP claimed
EP-3529300-B1 PLASTICIZED PVC ADMIXTURES WITH SURFACE MODIFYING MACROMOLECULES AND ARTICLES MADE THEREFROM EVONIK CANADA INC (CA) 2026-05-06 EP claimed
EP-4021643-B1 A COLLECTOR COMPOSITION FOR THE LITHIUM ORE OR MAGNESIUM ORE FLOTATION BASF SE (DE) 2025-12-03 EP claimed
EP-4442291-B1 MEDICAL NEEDLE TERUMO CORP (JP) 2025-11-19 EP claimed
US-12357729-B1 Organic biomaterial for bone and joint replacement IMAM MOHAMMAD IBN SAUD ISLAMIC UNIVERSITY (SA) 2025-07-15 US claimed
US-12325788-B2 Plasticized PVC admixtures with surface modifying macromolecules and articles made therefrom Evonik Canada Inc. (CA) 2025-06-10 US claimed
EP-3783059-B1 PLASTICIZER COMPOSITION AND RESIN COMPOSITION COMPRISING SAME LG CHEMICAL LTD (KR) 2025-05-14 EP claimed
EP-4347249-B1 SUBSTANTIALLY TRANSPARENT FLEXIBLE FILM AND METHOD FOR PRODUCING SAME FERRARI SERGE SAS (FR) 2025-05-07 EP claimed
WO-2025011923-A1 MULTI-COMPONENT RESIN SYSTEM COMPRISING AT LEAST ONE PLASTICISER, MORTAR COMPOSITION BASED ON ISOCYANATE-AMINE ADDUCTS, AND METHOD AND USE OF THE MULTI-COMPONENT RESIN SYSTEM FOR FASTENING CONSTRUCTION ELEMENTS HILTI AKTIENGESELLSCHAFT (LI) 2025-01-16 WO claimed
EP-4488306-A1 MULTICOMPONENT RESIN SYSTEM WITH AT LEAST ONE PLASTICIZER, MORTAR BASED ON ISOCYANATE-AMINE ADDUCTS, AND METHOD AND USE OF THE MULTICOMPONENT RESIN SYSTEM FOR FASTENING CONSTRUCTION ELEMENTS Hilti Aktiengesellschaft (LI) 2025-01-08 EP claimed
EP-0120873-B1 A BLOOD COMPONENT STORAGE CONTAINER AND METHOD UTILIZING A POLYVINYL CHLORIDE PLASTIC FORMULATION FREE OR ESSENTIALLY FREE OF LEACHABLE MATERIALS BAXTER INTERNATIONAL INC. (a Delaware corporation) (US) 1990-04-25 EP claimed
EP-0120873-A4 A BLOOD COMPONENT STORAGE CONTAINER AND METHOD UTILIZING A POLYVINYL CHLORIDE PLASTIC FORMULATION FREE OR ESSENTIALLY FREE OF LEACHABLE MATERIALS. BAXTER TRAVENOL LAB (US) 1986-11-26 EP claimed
US-4608056-A AROMATIC AND/OR CYCLOALIPHATIC POLYESTERS WITH POSSIBLE POLYOXYETHYLATION; DISPERSE DYES CRUCIBLE CHEMICAL COMPANY 1986-08-26 US claimed
US-4602916-A Dye composition and method of use thereof for coloring thermoplastic articles CRUCIBLE CHEMICAL COMPANY (US) 1986-07-29 US claimed
EP-0054221-B1 MULTIPLE BLOOD BAG SYSTEM MADE OF PLASTIC SUBSTANTIALLY FREE OF BLOOD EXTRACTIBLE PLASTICIZERS MILES INC. (US) 1986-04-09 EP claimed
US-4581035-A Waterless dye composition and method of use thereof for coloring thermoplastic articles CRUCIBLE CHEMICAL COMPANY (US) 1986-04-08 US claimed
US-4505708-A FATTY ACID SALT STABILIZER, PLASTICIZING BAXTER TRAVENOL LABORATORIES, INC. (US) 1985-03-19 US claimed
EP-0120873-A1 A BLOOD COMPONENT STORAGE CONTAINER AND METHOD UTILIZING A POLYVINYL CHLORIDE PLASTIC FORMULATION FREE OR ESSENTIALLY FREE OF LEACHABLE MATERIALS. BAXTER TRAVENOL LAB (US) 1984-10-10 EP claimed
WO-1984001286-A1 A BLOOD COMPONENT STORAGE CONTAINER AND METHOD UTILIZING A POLYVINYL CHLORIDE PLASTIC FORMULATION FREE OR ESSENTIALLY FREE OF LEACHABLE MATERIALS BAXTER TRAVENOL LAB (US) 1984-04-12 WO claimed
US-4326025-A EMULSIFIERS, STORAGE STABILITY BAXTER TRAVENOL LABORATORIES, INC. (US) 1982-04-20 US claimed