SCHEMBL2361293

SCHEMBL2361293

O=C(O)C12C=CC(C(=O)O)(C=C1)CCCC2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 1/20 0.39
CYP2C19 P33261 1/20 0.37
FFAR3 O14843 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
HSD11B1 P28845 1/20 0.31
HDAC4 P56524 1/20 0.30
DPP4 P27487 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
BLM P54132 1/20 0.30
CACNA2D1 P54289 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL10972957 0.97 CYP2C19 (0.41) AKR1C1CYP2C19FFAR3NPSR1HSD11B1
SCHEMBL1517959 0.88 FFAR3 (0.38) AKR1C1FFAR3
SCHEMBL11365266 0.78
Cyclohexane SCHEMBL7199629 0.77 CYP2C19 (0.32) AKR1C1CYP2C19
SCHEMBL8359918 0.74 LMNA (0.32) LMNA
SCHEMBL23245204 0.65 CYP2C19 (0.42) AKR1C1CYP2C19FFAR3NPSR1USP2
SCHEMBL208167 0.65 CYP2C19 (0.42) AKR1C1CYP2C19FFAR3NPSR1USP2
SCHEMBL440358 0.65 CYP2C19 (0.42) AKR1C1CYP2C19FFAR3NPSR1USP2
Hydrochloric Acid SCHEMBL4461485 0.65 CYP2C19 (0.42) AKR1C1CYP2C19FFAR3NPSR1USP2
SCHEMBL11208917 0.65 CYP2C19 (0.42) AKR1C1CYP2C19FFAR3NPSR1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4168483-B1 ANTIMONY TRIOXIDE FREE FLAME RETARDANT POLYMER COMPOSITION LANXESS CORP (US) 2024-04-24 EP claimed
US-20230323087-A1 Antimony Trioxide Free Flame Retardant Polymer Composition LANXESS CORPORATION (US) 2023-10-12 US claimed
US-9399699-B1 Compositions comprising polyester for 3D printing XEROX CORPORATION (US) 2016-07-26 US claimed
US-20160068693-A1 SUSTAINABLE RECYCLED MATERIALS FOR THREE-DIMENSIONAL PRINTING XEROX CORPORATION 2016-03-10 US claimed
US-6001952-A Polyester containing benzylidene having reduced fluorescence EASTMAN CHEMICAL COMPANY (US) 1999-12-14 US claimed
EP-0868488-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1998-10-07 EP claimed
WO-1997023568-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO claimed
US-5446122-A Process for preparing macrocyclic polyesters GENERAL ELECTRIC COMPANY (US) 1995-08-29 US claimed
US-4968746-A HIGH IMPACT STRENGTH MOLDING MATERIALS; REDUCED SURFACE GLOSS; NO SURFACE MOTTLING GENERAL ELECTRIC COMPANY (US) 1990-11-06 US claimed
EP-0079477-B1 MODIFIED POLYESTER COMPOSITIONS GENERAL ELECTRIC COMPANY (US) 1986-11-26 EP claimed
EP-0050262-B1 THERMOPLASTIC POLYESTER MOULDING MASSES BAYER AG (DE) 1985-01-09 EP claimed
EP-0020707-B1 MODIFIED POLYESTER COMPOSITIONS GENERAL ELECTRIC COMPANY (US) 1984-05-16 EP claimed
US-4417026-A Thermoplastic polyester moulding compositions having improved toughness BAYER AKTIENGESELLSCHAFT (DE) 1983-11-22 US claimed
EP-0079477-A1 Modified polyester compositions GENERAL ELECTRIC COMPANY (US) 1983-05-25 EP claimed
US-4184033-A Melt polymerization process for increasing the molecular weight of poly(1,4-butylene terephthalate) GENERAL ELECTRIC COMPANY (US) 1980-01-15 US claimed
US-4145335-A AND BRANCHED CHAIN DICARBOXYLIC ACID, TOUGHNESS CIBA-GEIGY CORPORATION (US) 1979-03-20 US claimed
US-3990603-A Easy open closure system MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-11-09 US claimed
JP-7238212-A None JP disclosed
US-4123410-A POLY(1,4-BUTYLENE TEREPHTHALATE, PLASTICIZER GENERAL ELECTRIC COMPANY (US) 1978-10-31 US disclosed
US-3990603-A Easy open closure system MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-11-09 US disclosed