SCHEMBL21067016

SCHEMBL21067016

C=C(C)CCCC(C)CCOC(=O)/C=C/C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
PTPN1 P18031 2/20 0.38
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HCAR2 Q8TDS4 4/20 0.32
GSTP1 P09211 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.30
TSHR P16473 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
SCHEMBL6854700 0.85 TSHR (0.46) ALOX15PTPN1ATMALDH1A1HPGD
SCHEMBL891472 0.81 ALOX15 (0.53) ALOX15PTPN1LMNAALDH1A1TSHR
SCHEMBL3504497 0.80 ALOX15 (0.40) ALOX15PTPN1TSHR
SCHEMBL17219845 0.79 HCAR2 (0.49) ALOX15ATMHCAR2HPGDTSHR
SCHEMBL28301762 0.78 CHRNB2 (0.46) ALOX15PTPN1LMNATSHR
SCHEMBL21067033 0.77 NAAA (0.41) ALOX15PTPN1TSHR
SCHEMBL21067035 0.77 NAAA (0.41) ALOX15PTPN1TSHR
SCHEMBL3506899 0.77 NAAA (0.41) ALOX15PTPN1TSHR
SCHEMBL5166720 0.76 ALOX15 (0.69) ALOX15LMNATDP1ALDH1A1TSHR
SCHEMBL3504718 0.76 DGKA (0.40) ALOX15PTPN1ATMTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109956850-B Process for producing 3, 7-dimethyl-7-octenyl alcohol and 3, 7-dimethyl-7-octenyl carboxylate compound 信越化学工业株式会社 2022-06-21 CN disclosed
EP-3505506-B1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND SHINETSU CHEMICAL CO (JP) 2021-02-03 EP disclosed
EP-3505506-B1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND SHINETSU CHEMICAL CO (JP) 2021-02-03 EP disclosed
EP-3505506-A1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND Shin-Etsu Chemical Co., Ltd. (JP) 2019-07-03 EP disclosed
EP-3505506-A1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND Shin-Etsu Chemical Co., Ltd. (JP) 2019-07-03 EP disclosed
CN-109956850-A The production method of 3,7- dimethyl -7- matsutake alcohol and 3,7- dimethyl -7- octenyl carboxylate compound 信越化学工业株式会社 2019-07-02 CN disclosed
US-20190194099-A1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-06-27 US disclosed
US-20190194099-A1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-06-27 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-20190194099-A1 METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENOL AND METHOD FOR PRODUCING 3,7-DIMETHYL-7-OCTENYL CARBOXYLATE COMPOUND AOX1, CASP7, CYP8B1 ALOX15 343/4885PTPN1 4437/4885ATM 3132/4885

“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.