SCHEMBL999364

SCHEMBL999364

CCCCCCC([O])c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.46
HTR2A P28223 1/20 0.45
ASAH1 Q13510 2/20 0.44
CSNK1E P49674 1/20 0.44
ALDH1A1 P00352 2/20 0.43
ACER2 Q5QJU3 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
POLB P06746 1/20 0.42
CNR2 P34972 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
OPRL1 P41146 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL1660346 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL6957724 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL11372249 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL6716460 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL1020302 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL1661440 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL999809 1.00 NAAA (0.46) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL997492 0.98 SIGMAR1 (0.44) NAAAHTR2AASAH1CSNK1EALDH1A1
SCHEMBL17534839 0.92 POLB (0.49) NAAAHTR2AALDH1A1SIGMAR1POLB
SCHEMBL921888 0.92 POLB (0.49) NAAAHTR2AALDH1A1SIGMAR1POLB

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 248 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
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-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
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
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
CN-109790269-B Isocyanate composition, method for producing isocyanate composition, and method for producing isocyanate polymer 旭化成株式会社 2022-06-14 CN disclosed
EP-1604687-A1 MICELLAR PREPARATION CONTAINING SPARINGLY WATER-SOLUBLE ANTICANCER AGENT AND NOVEL BLOCK COPOLYMER Nippon Kayaku Kabushiki Kaisha (JP) 2005-12-14 EP disclosed
US-20050170202-A1 Polymer and polymeric luminescent element comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-08-04 US disclosed
US-20040109955-A1 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2004-06-10 US disclosed
US-20040100804-A1 Solid pahse fluorescence; low molecular weight light emission diodes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-05-27 US disclosed
EP-1398340-A1 BLOCK COPOLYMER AND POLYMERIC LUMINESCENT ELEMENT Sumitomo Chemical Company, Limited (JP) 2004-03-17 EP disclosed
EP-1394188-A1 Polymer compound and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-03-03 EP disclosed
EP-0162208-B1 NOVEL N-SUBSTITUTED 3,4-DIHYDROPYRIMIDINE DERIVATIVES, PROCESSES FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS SUNTORY KABUSHIKI KAISHA, also known as SUNTORY LTD. (JP) 1989-11-23 EP disclosed
US-4683234-A HYPOTENSIVE AGENTS, ANTI-ANGINA SUNTORY LIMITED (JP) 1987-07-28 US disclosed
US-4670592-A BACTERICIDES, FUNGICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-06-02 US disclosed
EP-0162208-A2 Novel N-substituted 3,4-dihydropyrimidine derivatives, processes for preparing them and pharmaceutical compositions SUNTORY KABUSHIKI KAISHA, also known as SUNTORY LTD. (JP) 1985-11-27 EP 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-11548975-B2 Isocyanate composition and method for producing isocyanate polymer IDH3A, IDH2, IDH3B NAAA 521/4885HTR2A 4753/4885ASAH1 860/4885
US-20230114799-A1 ISOCYANATE COMPOSITION AND METHOD FOR PRODUCING ISOCYANATE POLYMER IDH3A, IDH2, IDH3B NAAA 456/4885HTR2A 4701/4885ASAH1 846/4885

“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.