SCHEMBL1005447

SCHEMBL1005447

CCCCc1cccc([O])c1CCCC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.40
MCL1 Q07820 3/20 0.40
BCL2L1 Q07817 2/20 0.40
BAK1 Q16611 2/20 0.40
KAT8 Q9H7Z6 2/20 0.40
PPARA Q07869 2/20 0.40
PPARG P37231 1/20 0.40
EP300 Q09472 1/20 0.40
KAT2A Q92830 1/20 0.40
KAT2B Q92831 1/20 0.40
KAT5 Q92993 1/20 0.40
SAE1 Q9UBE0 1/20 0.40
LIPG Q9Y5X9 1/20 0.39
ALOX5 P09917 1/20 0.39
PTGS2 P35354 1/20 0.39
CYSLTR2 Q9NS75 6/20 0.38
CYSLTR1 Q9Y271 6/20 0.38
CTRC Q99895 1/20 0.37
IAPP P10997 1/20 0.37

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
SCHEMBL1024235 0.94 BID (0.46) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9064974 0.92 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL11828078 0.92 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL1023302 0.92 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL6943220 0.92 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL1022131 0.92 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL2697186 0.92 GABRA1 (0.40) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL819273 0.85 LIPG (0.45) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL1005994 0.83 GABRA1 (0.38) BIDMCL1BCL2L1BAK1IAPP
Ammonia Solution, Strong SCHEMBL9810933 0.83 LIPG (0.44) BIDMCL1BCL2L1BAK1KAT8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107963982-B Polyisocyanate composition and isocyanate polymer composition 旭化成株式会社 2021-11-12 CN claimed
CN-118302407-A Carbonyl compound, method for producing isocyanate compound, and isocyanate composition 旭化成株式会社 2024-07-05 CN disclosed
CN-118215651-A Method for producing isocyanate compound, method for producing urethane compound, method for recovering amine compound, and isocyanate composition 旭化成株式会社 2024-06-18 CN disclosed
CN-111655758-B Nucleic acid delivery polymers 国立大学法人东京大学 2024-03-22 CN disclosed
WO-2023106377-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND 旭化成株式会社 2023-06-15 WO disclosed
WO-2023080258-A1 CARBONYL COMPOUND, METHOD FOR PRODUCING CARBONYL COMPOUND, METHOD FOR PRODUCING ISOCYANATE COMPOUND, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed
WO-2023080257-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed
CN-112979917-B Isocyanate composition, method for producing isocyanate composition, and method for producing isocyanate polymer 旭化成株式会社 2023-04-25 CN disclosed
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-04-13 US disclosed
US-11548975-B2 Isocyanate composition and method for producing isocyanate polymer ASAHI KASEI KABUSHIKI KAISHA (JP) 2023-01-10 US disclosed
EP-2088137-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Chemicals Corporation (JP) 2009-08-12 EP disclosed
EP-2088138-A1 PROCESS FOR PRODUCING ISOCYANATE Asahi Kasei Chemicals Corporation (JP) 2009-08-12 EP disclosed
EP-1473291-B1 PROCESS FOR PRODUCING LACTONE MITSUBISHI RAYON CO (JP) 2008-08-13 EP disclosed
US-20050080276-A1 Process for producing lactone MITSUBISHI CHEMICAL CORPORATION (JP) 2005-04-14 US disclosed
EP-1473291-A1 PROCESS FOR PRODUCING LACTONE Mitsubishi Rayon Co., Ltd. (JP) 2004-11-03 EP disclosed
EP-0390240-B1 Water soluble, nonionic cellulose ethers and their use in paints BEROL NOBEL AB (SE) 1995-07-12 EP disclosed
EP-0390240-A1 Water soluble, nonionic cellulose ethers and their use in paints BEROL NOBEL AB (SE) 1990-10-03 EP disclosed
US-4413045-A Multilayer electrophotographic photosensitive member comprises disazo charge generator layer, hydrazone transport layer CANON KABUSHIKI KAISHA (JP) 1983-11-01 US disclosed
US-4300942-A N-(Substituted carbonyl) derivatives of N-phos-phinylmethylglycinates and the herbicidal use thereof MONSANTO COMPANY (US) 1981-11-17 US disclosed
US-4251258-A N-(Substituted carbonyl) derivatives of N-phosphinylmethylglycinates and the herbicidal use thereof MONSANTO COMPANY (US) 1981-02-17 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 (3 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-11548975-B2 Isocyanate composition and method for producing isocyanate polymer IDH3A, IDH2, IDH3B BID 3812/4885MCL1 1337/4885BCL2L1 2682/4885
US-20050080276-A1 Process for producing lactone DCXR, MRPL21, LSS BID 3647/4885MCL1 196/4885BCL2L1 1155/4885
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER IDH3A, IDH2, IDH3B BID 3754/4885MCL1 1290/4885BCL2L1 2762/4885

“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.