Pentane

Pentane

SCHEMBL968651

CCCCC.ClC(Cl)Cl

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Pentane SCHEMBL11737194 0.96 TSHR (0.58)
Hexane SCHEMBL4325387 0.91 TSHR (0.58)
Hexane SCHEMBL9244722 0.91 TSHR (0.58)
Hexane SCHEMBL9879436 0.91 TSHR (0.58)
Hexane SCHEMBL4330650 0.91 TSHR (0.58)
Hexane SCHEMBL4333874 0.91 TSHR (0.58)
Hexane SCHEMBL3782949 0.91 TSHR (0.58)
Hexane SCHEMBL55152 0.91 TSHR (0.58)
Pentane SCHEMBL9002883 0.91
Benzene SCHEMBL11638876 0.89 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230110495-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. 2023-04-13 US disclosed
CN-114980886-A Compounds and methods for treating oxalate-related diseases 奥沙鲁克斯公司 2022-08-30 CN disclosed
US-11389456-B2 Compounds and methods for treating oxalate-related diseases OXALURX, INC. (US) 2022-07-19 US disclosed
EP-4017490-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES Oxalurx, Inc. (US) 2022-06-29 EP disclosed
WO-2021035196-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. (US) 2021-02-25 WO disclosed
US-20210052586-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. 2021-02-25 US disclosed
US-20200390778-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. 2020-12-17 US disclosed
WO-2019165159-A1 COMPOUNDS AND METHODS FOR TREATING OXALATE-RELATED DISEASES OXALURX, INC. (US) 2019-08-29 WO disclosed
EP-2176654-B1 BIOSENSOR UNIV LEEDS INNOVATIONS LTD (GB) 2017-03-22 EP disclosed
US-20160377571-A1 BIOSENSOR UNIVERSITY OF LEEDS (GB) 2016-12-29 US disclosed
US-4427685-A ANTIHISTAMINES, ANTIINFALMMATORY AGENTS BEECHAM GROUP P.L.C. (GB) 1984-01-24 US disclosed
US-4407823-A ANTIINFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1983-10-04 US disclosed
EP-0089153-A2 Pyridine derivatives SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1983-09-21 EP disclosed
US-4396626-A (1-METHYL-4-TRIFLUOROMETHYL-5-ARYLCARBONYL-4-PYRRYL)ALKANOIC ACID OR DERIVATIVE; ANALGESIC, ANTIINFLAMMATORY BEECHAM GROUP LIMITED (GB) 1983-08-02 US disclosed
US-4376121-A Antiallerigically-active imidazothienopyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 1983-03-08 US disclosed
US-4182891-A ENZYME INHIBITORS, IMMUNOSUPPRESSANTS, CONTROL OF NEOPLASTIC GROWTH MERRELL TORAUDE ET COMPAGNIE (FR) 1980-01-08 US disclosed
US-4073936-A Hypolipidemic allene carboxylic esters SANDOZ, INC. (US) 1978-02-14 US disclosed
US-4036840-A ENZYME INHIBITORS ICN PHARMACEUTICALS (US) 1977-07-19 US disclosed
US-3998808-A INSECTICIDES, FUNGICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-12-21 US disclosed
US-3940441-A BACTERICIDE STERLING DRUG INC. (US) 1976-02-24 US disclosed