SCHEMBL22115671

SCHEMBL22115671

CC(=O)/C1=C(/C)CC/C=C(\C)CC/C=C(\C)CC1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.39
MET P08581 1/20 0.36
TAS2R46 P59540 2/20 0.33
PTAFR P25105 1/20 0.33
GLI1 P08151 1/20 0.30
CYP3A4 P08684 1/20 0.30
GLI2 P10070 1/20 0.30

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
SCHEMBL14694331 1.00 PTPN1 (0.39) PTPN1METTAS2R46PTAFRGLI1
SCHEMBL14694330 1.00 PTPN1 (0.39) PTPN1METTAS2R46PTAFRGLI1
SCHEMBL21004882 0.81 TAS2R46 (0.32) METTAS2R46
SCHEMBL21004881 0.81 TAS2R46 (0.32) METTAS2R46
SCHEMBL2902703 0.71 PTPN1 (0.56) PTPN1METTAS2R46GLI1CYP3A4
SCHEMBL2902701 0.71 PTPN1 (0.56) PTPN1METTAS2R46GLI1CYP3A4
SCHEMBL2902702 0.71 PTPN1 (0.56) PTPN1METTAS2R46GLI1CYP3A4
SCHEMBL316206 0.71 PTPN1 (0.54) PTPN1METTAS2R46PTAFRGLI1
SCHEMBL1269324 0.71 PTPN1 (0.54) PTPN1METTAS2R46PTAFRGLI1
SCHEMBL316207 0.71 PTPN1 (0.54) PTPN1METTAS2R46PTAFRGLI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233425-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE THE PERCEPTION OF MALODOR FIRMENICH SA (CH) 2023-07-27 US claimed
US-20200345601-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE THE PERCEPTION OF MALODOR FIRMENICH SA (CH) 2020-11-05 US claimed
EP-4632382-A2 METHOD OF IDENTIFYING LAUNDRY MALODOR, MOLDY MALODOR AND/OR SWEAT MALODOR MODULATING COMPOUNDS Firmenich SA (CH) 2025-10-15 EP disclosed
EP-3883927-B1 AMBER ODORANT FIRMENICH & CIE (CH) 2025-10-01 EP disclosed
US-12139469-B2 Amber odorant FIRMENICH SA (CH) 2024-11-12 US disclosed
CN-111183136-B Amber odorant 弗门尼舍有限公司 2024-05-28 CN disclosed
US-11744785-B2 Use of volatile compositions to limit or eliminate the perception of malodor FIRMENICH SA (CH) 2023-09-05 US disclosed
US-20230233425-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE THE PERCEPTION OF MALODOR FIRMENICH SA (CH) 2023-07-27 US disclosed
US-20220106285-A1 AMBER ODORANT FIRMENICH SA (CH) 2022-04-07 US disclosed
CN-113423700-A Amber flavor agent 弗门尼舍有限公司 2021-09-21 CN disclosed
EP-3668850-B1 AMBER ODORANT FIRMENICH & CIE (CH) 2021-07-14 EP disclosed
US-10889558-B2 Amber odorant FIRMENICH SA (CH) 2021-01-12 US disclosed
US-20210003553-A1 METHOD OF IDENTIFYING LAUNDRY MALODOR, MOLDY MALODOR AND/OR SWEAT MALODOR MODULATING COMPOUNDS FIRMENICH SA (CH) 2021-01-07 US disclosed
US-20200345601-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE THE PERCEPTION OF MALODOR FIRMENICH SA (CH) 2020-11-05 US disclosed
US-20200299254-A1 AMBER ODORANT FIRMENICH SA (CH) 2020-09-24 US disclosed
EP-3668850-A1 AMBER ODORANT Firmenich SA (CH) 2020-06-24 EP disclosed
CN-111183136-A Amber odorant 弗门尼舍有限公司 2020-05-19 CN 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 (7 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-10889558-B2 Amber odorant TRPA1, TAS2R41, OPRM1 PTPN1 3190/4885MET 4825/4885TAS2R46 68/4885
US-20220106285-A1 AMBER ODORANT OPRM1, TRPA1, PYM1 PTPN1 3842/4885MET 4810/4885TAS2R46 77/4885
US-11744785-B2 Use of volatile compositions to limit or eliminate the perception of malodor TAS2R8, TRPA1, TAS2R10 PTPN1 633/4885MET 3691/4885TAS2R46 54/4885
US-20200345601-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE THE PERCEPTION OF MALODOR TAS2R8, TRPA1, TAS2R10 PTPN1 633/4885MET 3691/4885TAS2R46 54/4885
US-20200299254-A1 AMBER ODORANT TRPA1, TAS2R41, OPRM1 PTPN1 3190/4885MET 4825/4885TAS2R46 68/4885
US-20230233425-A1 USE OF VOLATILE COMPOSITIONS TO LIMIT OR ELIMINATE THE PERCEPTION OF MALODOR TAS2R8, TRPA1, TAS2R10 PTPN1 633/4885MET 3691/4885TAS2R46 54/4885
US-12139469-B2 Amber odorant OPRM1, TRPA1, PYM1 PTPN1 3842/4885MET 4810/4885TAS2R46 77/4885

“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.