SCHEMBL18935977

SCHEMBL18935977

CCOC(=O)C1=NOC(CCCOCc2ccccc2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.48
ITGB3 P05106 4/20 0.43
ITGAV P06756 3/20 0.43
ITGA2B P08514 2/20 0.43
HTT P42858 1/20 0.42
CYP3A4 P08684 2/20 0.42
POLB P06746 1/20 0.42
CYP2C19 P33261 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
NAAA Q02083 1/20 0.39
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
CSNK1D P48730 1/20 0.38
MIF P14174 1/20 0.37
TSHR P16473 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
SCHEMBL18936040 0.97 ALDH1A1 (0.50) ALDH1A1L3MBTL1ITGB3ITGAVITGA2B
SCHEMBL17490895 0.96 ALDH1A1 (0.49) ALDH1A1L3MBTL1ITGB3ITGAVITGA2B
SCHEMBL18935994 0.96 ALDH1A1 (0.49) ALDH1A1L3MBTL1ITGB3ITGAVITGA2B
SCHEMBL18936036 0.93 ALDH1A1 (0.53) ALDH1A1L3MBTL1ITGB3ITGAVITGA2B
SCHEMBL18936001 0.90 ALDH1A1 (0.50) ALDH1A1L3MBTL1ITGB3ITGAVITGA2B
SCHEMBL19180311 0.88 ALDH1A1 (0.46) ALDH1A1L3MBTL1HTTCYP3A4POLB
SCHEMBL19194711 0.86 HDAC3 (0.43) ALDH1A1L3MBTL1ITGB3ITGAVITGA2B
SCHEMBL18935979 0.86 ALDH1A1 (0.60) ALDH1A1L3MBTL1HTTCYP3A4POLB
SCHEMBL17490749 0.86 HDAC3 (0.45) L3MBTL1ITGB3ITGAVITGA2BHDAC3
SCHEMBL18935969 0.85 ALDH1A1 (0.56) ALDH1A1L3MBTL1HTTCYP3A4POLB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3178323-B1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2021-06-23 EP disclosed
US-9854803-B2 Noxious arthropod control agent containing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-02 US disclosed
US-9854803-B2 Noxious arthropod control agent containing amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-01-02 US disclosed
US-20170215424-A1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-03 US disclosed
US-20170215424-A1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-03 US disclosed
US-20170215424-A1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-08-03 US disclosed
EP-3178323-A1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2017-06-14 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 (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-20170215424-A1 NOXIOUS ARTHROPOD CONTROL AGENT CONTAINING AMIDE COMPOUND TRPA1, OPRM1, OPRL1 ALDH1A1 2079/4885L3MBTL1 12/4885ITGB3 4263/4885

“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.