SCHEMBL837779

SCHEMBL837779

O=P(OCCl)(OCCl)OCCl

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
TSHR P16473 2/20 0.44
CYP3A4 P08684 2/20 0.36
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL1369041 0.85 TSHR (0.72) ALDH1A1TSHRCYP3A4TP53TDP1
SCHEMBL9974613 0.81
SCHEMBL12811584 0.81 CYP3A4 (0.54) ALDH1A1TSHRCYP3A4TP53TDP1
SCHEMBL11647259 0.79 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL14934973 0.79 ALDH1A1 (0.39) ALDH1A1TSHRCYP3A4
SCHEMBL4055518 0.77 CYP3A4 (0.77) ALDH1A1TSHRCYP3A4
SCHEMBL15479076 0.75 ALDH1A1 (0.46) ALDH1A1TSHRCYP3A4
SCHEMBL28237157 0.74 CTSA (0.40) ALDH1A1TSHR
SCHEMBL194036 0.74 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL17333478 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027098-A Prodrugs of ospirimol and derivatives thereof, and preparation method and application thereof 珠海安哲医药科技有限公司 2024-05-14 CN claimed
CN-112979860-A Wear-resistant flame-retardant organic glass plate and preparation method thereof 安徽新涛光电科技有限公司 2021-06-18 CN claimed
CN-112538226-A Flame-retardant PMMA light diffusion plate and preparation method thereof 安徽新涛光电科技有限公司 2021-03-23 CN claimed
CN-108325560-B Catalyst, preparation method thereof and method for preparing 3-hydroxy propionaldehyde 万华化学集团股份有限公司 2020-09-08 CN claimed
CN-111286418-A Plane grinding cleaning agent and preparation method thereof 苏州衍生生物科技有限公司 2020-06-16 CN claimed
CN-108325560-A A kind of catalyst and preparation method thereof and the method for preparing 3-HPA 万华化学集团股份有限公司 2018-07-27 CN claimed
EP-2448950-A1 SYNTHESIS OF N4- (2, 2-DIMETHYL-4- [ (DIHYDROGEN PHOSPHONOXY]-3-OXO-5-PYRIDO [1, 4]OXAZIN-6-YL)-5-FLUORO-N2- (3, 4, 5,-TRIMETHOXYPHENYL) -2, 4- PYRIMIDINEDIAMINE DISODIUM SALT Rigel Pharmaceuticals, Inc. (US) 2012-05-09 EP claimed
WO-2011002999-A1 SYNTHESIS OF N4- (2, 2-DIMETHYL-4- [ (DIHYDROGEN PHOSPHONOXY ] -3-OXO-5-PYRIDO [1, 4] OXAZIN-6-YL)-5-FLUORO-N2- (3, 4, 5,-TRIMETHOXYPHENYL) -2, 4- PYRIMIDINEDIAMINE DISODIUM SALT RIGEL PHARMACEUTICALS, INC. (US) 2011-01-06 WO claimed
JP-7292152-A None JP disclosed
CN-119899510-A Modified polycarbonate material, preparation method thereof and explosion-proof flame-retardant composite material 北京航玻新材料技术有限公司 2025-04-29 CN disclosed
EP-4486455-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2025-01-08 EP disclosed
CN-111094258-B Diazole compound and agricultural/horticultural fungicide 日本曹达株式会社 2024-11-08 CN disclosed
CN-118843629-A Antiviral compounds and methods of making and using the same 吉利德科学公司 2024-10-25 CN disclosed
US-20240287108-A1 nSMASE2 INHIBITOR PRODRUGS WITH ENHANCED ORAL AND BRAIN EXPOSURES THE JOHNS HOPKINS UNIVERSITY 2024-08-29 US disclosed
EP-1485085-A1 PHOSPHATE PRODRUGS OF FLUOROOXINDOLES Bristol-Myers Squibb Company (US) 2004-12-15 EP disclosed
US-20030195169-A1 Phosphate prodrugs of fluorooxindoles BRISTOL-MYERS SQUIBB COMPANY 2003-10-16 US disclosed
WO-2003080047-A1 PHOSPHATE PRODRUGS OF FLUOROOXINDOLES BRISTOL-MYERS SQUIBB COMPANY (US) 2003-10-02 WO 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-5747569-A (METH)ACRYLATE ESTER WITH (METH)ACRYLIC ACID AND PHOSPHOROUS COMPOUND FOR FIRE RETARDANT CAST PANELS ATOHAAS HOLDING C.V. (NL) 1998-05-05 US disclosed
JP-H07292152-A FLAME PROOFING AGENT COMPOSITION FOR FOAMED RESIN FUJIMASU JIRO 1995-11-07 JP 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-20240287108-A1 nSMASE2 INHIBITOR PRODRUGS WITH ENHANCED ORAL AND BRAIN EXPOSURES SGMS2, SMPD2, CERS2 ALDH1A1 3493/4885TSHR 4859/4885CYP3A4 2221/4885
US-20030195169-A1 Phosphate prodrugs of fluorooxindoles KCNA5, KCNN3, CACNA1E ALDH1A1 1617/4885TSHR 1959/4885CYP3A4 525/4885

“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.