SCHEMBL19952969

SCHEMBL19952969

CC/C=C\C/C=C\CCC1OCCO1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
CYP19A1 P11511 4/20 0.42
PPARG P37231 3/20 0.42
OXER1 Q8TDS5 3/20 0.42
MAPT P10636 3/20 0.42
RXRA P19793 2/20 0.42
FFAR1 O14842 2/20 0.42
F7 P08709 3/20 0.40
F3 P13726 3/20 0.40
PPARA Q07869 3/20 0.40
PTGS1 P23219 3/20 0.40
KMT2A Q03164 2/20 0.40
PPARD Q03181 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
NR1I2 O75469 2/20 0.38
PTGS2 P35354 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
PLA2G1B P04054 1/20 0.38

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
SCHEMBL12723043 0.82 ALDH1A1 (0.37) ALDH1A1CYP19A1PPARGOXER1MAPT
SCHEMBL19783686 0.78 ALDH1A1 (0.41) ALDH1A1CYP19A1PPARGOXER1MAPT
SCHEMBL18019059 0.75 ALDH1A1 (0.41) ALDH1A1CYP19A1PPARGOXER1MAPT
SCHEMBL18019060 0.75 ALDH1A1 (0.41) ALDH1A1CYP19A1PPARGOXER1MAPT
SCHEMBL23533342 0.74
SCHEMBL4002952 0.74
SCHEMBL4002944 0.74
SCHEMBL18019055 0.73 ALDH1A1 (0.39) ALDH1A1CYP19A1PPARGOXER1MAPT
SCHEMBL18019086 0.73 ALDH1A1 (0.39) ALDH1A1CYP19A1PPARGOXER1MAPT
SCHEMBL4002095 0.72 ALDH1A1 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510010-B1 TASTE MODULATING ALDEHYDE TAKASAGO PERFUMERY CO LTD (JP) 2023-09-06 EP disclosed
US-11540542-B2 Taste modulating aldehydes TAKASAGO INTERNATIONAL CORPORATION (JP) 2023-01-03 US disclosed
CN-109996778-B Taste modifying aldehydes 高砂香料工业株式会社 2022-12-13 CN disclosed
EP-3510010-A1 TASTE MODULATING ALDEHYDES Takasago International Corporation (JP) 2019-07-17 EP disclosed
US-20190208806-A1 TASTE MODULATING ALDEHYDES TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-07-11 US disclosed
WO-2018049352-A1 TASTE MODULATING ALDEHYDES TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2018-03-15 WO 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-11540542-B2 Taste modulating aldehydes TAS2R10, TAS2R50, TAS2R1 ALDH1A1 39/4885CYP19A1 4684/4885PPARG 339/4885
US-20190208806-A1 TASTE MODULATING ALDEHYDES TAS2R10, TAS2R50, TAS2R1 ALDH1A1 39/4885CYP19A1 4684/4885PPARG 339/4885

“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.