SCHEMBL7927729

SCHEMBL7927729

C=CCOCC1CC=CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.43
LMNA P02545 4/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CDK1 P06493 2/20 0.34
CCNB1 P14635 2/20 0.34
CCNA2 P20248 2/20 0.34
CDK2 P24941 2/20 0.34
CCNA1 P78396 2/20 0.34
HTT P42858 2/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
APOBEC3A P31941 2/20 0.31
APOBEC3G Q9HC16 2/20 0.31
RGS12 O14924 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PABPC1 P11940 1/20 0.31
EIF4H Q15056 1/20 0.31

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
SCHEMBL19695510 1.00 ALDH1A1 (0.44) ALDH1A1ALOX15MAPK1LMNATSHR
SCHEMBL7973683 0.82 MAPK1 (0.56) ALDH1A1ALOX15MAPK1LMNATSHR
SCHEMBL19695343 0.79 MAPK1 (0.41) ALDH1A1MAPK1LMNATSHRSMN1; SMN2
SCHEMBL19695504 0.79 MAPK1 (0.41) ALDH1A1MAPK1LMNATSHRSMN1; SMN2
SCHEMBL19695375 0.79 MAPK1 (0.41) ALDH1A1MAPK1LMNATSHRSMN1; SMN2
SCHEMBL472171 0.79 MAPK1 (0.46) ALDH1A1ALOX15MAPK1LMNATSHR
SCHEMBL7260723 0.78 MAPK1 (0.49) ALDH1A1ALOX15MAPK1LMNATSHR
SCHEMBL19695044 0.77 MAPK1 (0.40) ALDH1A1MAPK1LMNATSHRSMN1; SMN2
SCHEMBL19695311 0.77 MAPK1 (0.40) ALDH1A1MAPK1LMNATSHRSMN1; SMN2
SCHEMBL19707936 0.77 ALDH1A1 (0.37) ALDH1A1ALOX15MAPK1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190153354-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-05-23 US claimed
CN-109310601-B Fragrance material 高砂香料工业株式会社 2022-05-24 CN disclosed
EP-3468526-B1 FRAGRANCE MATERIAL TAKASAGO PERFUMERY CO LTD (JP) 2021-05-12 EP disclosed
US-10745646-B2 Fragrance material TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-08-18 US disclosed
US-10745646-B2 Fragrance material TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-08-18 US disclosed
US-20190153354-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-05-23 US disclosed
US-20190153354-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-05-23 US disclosed
EP-3468526-A1 FRAGRANCE MATERIAL Takasago International Corporation (JP) 2019-04-17 EP disclosed
WO-2017214455-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2017-12-14 WO disclosed
WO-2017214455-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2017-12-14 WO disclosed
US-6235808-B1 Radiation-curable cycloaliphatic epoxy compounds, uses thereof, and compositions containing them RENSSELAER POLYTECHNIC INSTITUTE 2001-05-22 US disclosed
US-6075155-A PHOTOPOLYMERIZABLE MONOMERS; SOLVENT-FREE RENSSELAER POLYTECHNIC INSTITUTE (US) 2000-06-13 US 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-10745646-B2 Fragrance material TRPA1, TRPV1, NISCH ALDH1A1 297/4885ALOX15 119/4885MAPK1 3927/4885

“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.