SCHEMBL4190728

SCHEMBL4190728

CCCCCCN(CC1CCCCC1)c1cccc(O)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 15/20 0.48
OPRD1 P41143 14/20 0.48
OPRK1 P41145 14/20 0.48
ALDH1A1 P00352 1/20 0.47
CYP3A4 P08684 1/20 0.47
HTR7 P34969 2/20 0.43
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41

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
SCHEMBL10430297 0.82 ALDH1A1 (0.62) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL7793677 0.82 ALDH1A1 (0.62) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL16166065 0.82 ALDH1A1 (0.62) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL7793517 0.82 ALDH1A1 (0.62) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL9629105 0.82 ALDH1A1 (0.62) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL6055692 0.82 ALDH1A1 (0.62) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL9166655 0.81 ALDH1A1 (0.61) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL9161840 0.81 ALDH1A1 (0.61) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL3319482 0.81 ALDH1A1 (0.65) OPRM1OPRD1OPRK1ALDH1A1CYP3A4
SCHEMBL1425130 0.80 ALDH1A1 (0.69) OPRM1OPRD1OPRK1ALDH1A1CYP3A4

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
WO-2023084906-A1 COMPOSITION FOR FORMING WAVELENGTH CONVERSION FILM FOR DISPLAY 日産化学株式会社 2023-05-19 WO disclosed
US-20090043116-A1 HETERO-POLYCYCLIC COMPOUNDS, AND COLORING MATTERS, PIGMENTS, DYES, COLOR-CHANGING MATERIAL COMPOSITIONS, AND COLOR-CHANGING FILMS, MADE BY USING THE COMPOUNDS IDEMITSU KOSAN CO., LTD. (JP) 2009-02-12 US disclosed
US-20080290329-A1 HETERO-POLYCYCLIC COMPOUNDS, AND COLORING MATTERS, PIGMENTS, DYES, COLOR-CHANGING MATERIAL COMPOSITIONS, AND COLOR-CHANGING FILMS, MADE BY USING THE COMPOUNDS IDEMITSU KOSAN CO., LTD. (JP) 2008-11-27 US disclosed
US-7420065-B2 Color-changing performance does not deteriorate even after used for long time and which is prevented from being unusable due to deposition of the coloring matter during storage IDEMITSU KOSAN CO., LTD. (JP) 2008-09-02 US disclosed
US-20060235060-A1 Hetero-polycyclic compounds, and coloring matters, pigments, dyes, color-changing material compositions, and color-changing films, made by using the compounds IDEMITSU KOSAN CO., LTD. (JP) 2006-10-19 US disclosed
CN-1747943-A Heteropolycyclic compound, and coloring matter, pigment, dye, color-changing material composition and color-changing film prepared therefrom IDEMITSU KOSAN CO (JP) 2006-03-15 CN disclosed
EP-1593675-A1 HETERO-POLYCYCLIC COMPOUNDS, AND COLORING MATTERS, PIGMENTS, DYES, COLOR-CHANGING MATERIAL COMPOSITIONS, AND COLOR-CHANGING FILMS, MADE BY USING THE COMPOUNDS IDEMITSU KOSAN CO., LTD. (JP) 2005-11-09 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 (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-20080290329-A1 HETERO-POLYCYCLIC COMPOUNDS, AND COLORING MATTERS, PIGMENTS, DYES, COLOR-CHANGING MATERIAL COMPOSITIONS, AND COLOR-CHANGING FILMS, MADE BY USING THE COMPOUNDS PBRM1, BICRA, PARG OPRM1 2908/4885OPRD1 4187/4885OPRK1 3306/4885
US-20090043116-A1 HETERO-POLYCYCLIC COMPOUNDS, AND COLORING MATTERS, PIGMENTS, DYES, COLOR-CHANGING MATERIAL COMPOSITIONS, AND COLOR-CHANGING FILMS, MADE BY USING THE COMPOUNDS PBRM1, BICRA, PARG OPRM1 2908/4885OPRD1 4187/4885OPRK1 3306/4885
US-20060235060-A1 Hetero-polycyclic compounds, and coloring matters, pigments, dyes, color-changing material compositions, and color-changing films, made by using the compounds PBRM1, BICRA, PARG OPRM1 2908/4885OPRD1 4187/4885OPRK1 3306/4885

“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.