SCHEMBL634663

SCHEMBL634663

CCCCOP(=O)(O)OCCl

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.52
LPAR3 Q9UBY5 8/20 0.50
LPAR2 Q9HBW0 6/20 0.50
LPAR1 Q92633 3/20 0.50
TSHR P16473 1/20 0.41
P2RY10 O00398 4/20 0.38
GPR34 Q9UPC5 2/20 0.38

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
Chloromethane SCHEMBL11360800 0.89 CYP3A4 (0.58) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL26559 0.89 CYP3A4 (0.64) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL29177519 0.89 CYP3A4 (0.64) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL15389152 0.89 CYP3A4 (0.64) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL27690619 0.88 CYP3A4 (0.52) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL27465608 0.87 LPAR3 (0.39) CYP3A4LPAR3LPAR2LPAR1
Methane SCHEMBL11359992 0.87 CYP3A4 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL11677508 0.87 CYP3A4 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL4631198 0.87 CYP3A4 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR
Ammonia Solution, Strong SCHEMBL5519376 0.87 CYP3A4 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-216396344-U Di-tert-butyl chloromethyl phosphate production is with taking stirring inside lining to prepare cauldron 武汉康贝德生物科技有限公司 2022-04-29 CN claimed
JP-4734318-B2 2011-07-27 JP claimed
US-7745625-B2 Prodrugs of piperazine and substituted piperidine antiviral agents BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-29 US claimed
EP-1725569-B1 PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS BRISTOL MYERS SQUIBB CO (US) 2008-01-23 EP claimed
EP-1725569-A1 PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS Bristol-Myers Squibb Company (US) 2006-11-29 EP claimed
WO-2005090367-A1 PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-09-29 WO claimed
US-20050209246-A1 Prodrugs of piperazine and substituted piperidine antiviral agents SALZUFER HOLDING INC., AS ADMINISTRATIVE AGENT 2005-09-22 US claimed
WO-2023196614-A1 METHODS AND COMPOUNDS FOR TREATING NEUROLOGICAL DISORDERS AXONIS THERAPEUTICS, INC. (US) 2023-10-12 WO disclosed
WO-2023055686-A1 LPXC INHIBITORS AND USES THEREOF BLACKSMITH MEDICINES, INC. (US) 2023-04-06 WO disclosed
EP-4126863-A1 1 H-PYRAZOLO[4,3-G]ISOQUINOLINE AND 1 H-PYRAZOLO[4,3-G]QUINOLINE DERIVATIVES AS ALPHA-1 -ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1 -ANTITRYPSIN DEFICIENCY (AATD) Vertex Pharmaceuticals Incorporated (US) 2023-02-08 EP disclosed
WO-2022206512-A1 5-BENZYLIMIDAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF 四川大学华西医院 2022-10-06 WO disclosed
EP-4003340-A2 ETHYNYLHETEROCYCLES AS RHO-ASSOCIATED COILED-COIL KINASE (ROCK) INHIBITORS Angion Biomedica Corp. (US) 2022-06-01 EP disclosed
WO-2021203025-A1 1 H-PYRAZOLO[4,3-G]ISOQUINOLINE AND 1 H-PYRAZOLO[4,3-G]QUINOLINE DERIVATIVES AS ALPHA-1 -ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1 -ANTITRYPSIN DEFICIENCY (AATD) VERTEX PHARMACEUTICALS INCORPORATED (US) 2021-10-07 WO disclosed
WO-2010065893-A1 RAF INHIBITORS AND THEIR USES ARQULE, INC. (US) 2010-06-10 WO disclosed
EP-2121029-A2 PRODRUGS AND METHODS OF MAKING AND USING THE SAME Neurogesx, Inc. (US) 2009-11-25 EP disclosed
WO-2008070149-A2 PRODRUGS AND METHODS OF MAKING AND USING THE SAME NEUROGESX, INC. (US) 2008-06-12 WO disclosed
EP-1891070-A1 PRODRUGS OF A2B ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2008-02-27 EP disclosed
EP-1856135-A1 PRODRUGS OF 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES Rigel Pharmaceuticals, Inc. (US) 2007-11-21 EP disclosed
WO-2006138376-A1 PRODRUGS OF A2B ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2006-12-28 WO disclosed
WO-2006078846-A1 PRODRUGS OF 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2006-07-27 WO 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 (1 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-20050209246-A1 Prodrugs of piperazine and substituted piperidine antiviral agents ZC3HAV1L, CCR5, CCRL2 CYP3A4 1230/4885LPAR3 322/4885LPAR2 289/4885

“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.