SCHEMBL4669704

SCHEMBL4669704

CCCCC(Cl)OP(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.55
FDPS P14324 6/20 0.48
PTPN1 P18031 1/20 0.44
LPAR3 Q9UBY5 3/20 0.41
LPAR1 Q92633 2/20 0.41
LPAR2 Q9HBW0 2/20 0.41
LAP3 P28838 1/20 0.39
S1PR2 O95136 5/20 0.39
S1PR1 P21453 5/20 0.39
S1PR3 Q99500 5/20 0.39
S1PR4 O95977 4/20 0.39

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
SCHEMBL9499300 0.87 SMPD1 (0.48) SMPD1FDPSPTPN1LPAR3LPAR1
SCHEMBL27759001 0.86 SMPD1 (0.48) SMPD1FDPSLAP3S1PR2S1PR1
SCHEMBL29288454 0.84 FDPS (0.45) SMPD1FDPSPTPN1LAP3S1PR2
SCHEMBL4669700 0.83 CYP3A4 (0.44) SMPD1FDPSS1PR2S1PR1S1PR3
SCHEMBL27727331 0.81 FDPS (0.42) SMPD1FDPSLAP3S1PR2S1PR1
SCHEMBL1923648 0.78 SMPD1 (0.59) SMPD1FDPSPTPN1LPAR3LPAR1
SCHEMBL1477860 0.78
SCHEMBL28189880 0.77 PLA2G2C (0.40) SMPD1FDPSPTPN1LPAR3LPAR1
SCHEMBL27748409 0.77 FDPS (0.39) SMPD1FDPSLPAR3LPAR1LPAR2
SCHEMBL3010735 0.77 SMPD1 (0.57) SMPD1FDPSPTPN1LPAR3LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114288760-B Fuel cell cathode air filtering adsorption filter material and application thereof 广州华创化工材料科技开发有限公司 2022-07-12 CN claimed
CN-114288760-A Fuel cell cathode air filtering adsorption filter material and application thereof 广州华创化工材料科技开发有限公司 2022-04-08 CN claimed
CN-104689849-A Phosphamide-(di) secondary amine dual-functional catalyst and synthesis method thereof UNIV EAST CHINA NORMAL 2015-06-10 CN claimed
CN-102040630-A Preparation method of three-in-one acrylic acid phosphoric melamine expansion flame retardant oligomer UNIV NANCHANG HANGKONG 2011-05-04 CN claimed
CN-117364487-B Preparation method of durable flame-retardant coating polyester/cotton blended fabric 江苏恒力化纤股份有限公司 2024-03-19 CN disclosed
CN-117364487-A Preparation method of durable flame-retardant coating polyester/cotton blended fabric 江苏恒力化纤股份有限公司 2024-01-09 CN disclosed
WO-2023102529-A1 THERAPEUTIC COMPOUNDS FOR HIV VIRUS INFECTION GILEAD SCIENCES, INC. (US) 2023-06-08 WO disclosed
CN-115109420-A Flame-retardant polyvinyl alcohol modified composition and preparation method thereof 电子科技大学中山学院 2022-09-27 CN disclosed
CN-114288760-B Fuel cell cathode air filtering adsorption filter material and application thereof 广州华创化工材料科技开发有限公司 2022-07-12 CN disclosed
CN-114288760-A Fuel cell cathode air filtering adsorption filter material and application thereof 广州华创化工材料科技开发有限公司 2022-04-08 CN disclosed
CN-114196002-A Preparation method of transparent flame-retardant novel polycarbonate, polycarbonate and application thereof 万华化学(宁波)有限公司 2022-03-18 CN disclosed
CN-111925728-A Modified epoxy resin powder coating with high adhesive force 何瑞坚 2020-11-13 CN disclosed
US-6448401-B1 REACTING A TRIAZOLE ANTIFUNGAL COMPOUND CONTAINING A SECONDARY OR TERTIARY HYDROXYL GROUP WITH A PROTECTED MONOCHLOROMETHYL PHOSPHATE; IODIDE ION SOURCE; ORGANIC SOLVENT; BASE BRISTOL-MYERS SQUIBB COMPANY 2002-09-10 US disclosed
WO-2002042283-A1 IMPROVED PROCESS FOR WATER SOLUBLE AZOLE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-05-30 WO disclosed
US-20020062028-A1 Process for water soluble azole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2002-05-23 US disclosed
US-6362172-B2 (DIHYDROGEN PHOSPHONOXY)ALKYLOXY CONTAINING A TRIAZOLE DERIVATIVE USED AS ANTIFUNGAL AGENT BRISTOL-MYERS SQUIBB COMPANY 2002-03-26 US disclosed
US-20010041691-A1 Water soluble prodrugs of azole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2001-11-15 US disclosed
WO-2001052852-A1 WATER SOLUBLE PRODRUGS OF AZOLE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2001-07-26 WO disclosed
US-4604409-A Polyamide-imide foams and methods of making same IMI-TECH CORPORATION, ELK GROVE, ILL. A CORP. OF 1986-08-05 US disclosed
US-4585805-A Polyamide-imide foams and methods of making same IMI-TECH CORPORATION, ELK GROVE, ILL. A CORP. OF 1986-04-29 US 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 (2 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-20010041691-A1 Water soluble prodrugs of azole compounds CYP51A1, ERG28, CYP7A1 SMPD1 1988/4885FDPS 702/4885PTPN1 684/4885
US-20020062028-A1 Process for water soluble azole compounds CYP51A1, ERG28, CYP7A1 SMPD1 2265/4885FDPS 423/4885PTPN1 755/4885

“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.