SCHEMBL19973096

SCHEMBL19973096

CC1(C)C[C@H]2[C@H]1CC[C@@]1(C)C[C@]2(C)OC1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.42
ALDH1A1 P00352 3/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
F10 P00742 1/20 0.36
FTH1 P02794 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL13057404 0.75 F10 (0.36) CYP3A4LMNAMAPTF10
SCHEMBL24524173 0.61 CYP3A4 (0.33) CYP3A4ALDH1A1USP2LMNAMAPT
3,7-Epoxycaryophyllan-6-Ol SCHEMBL24176170 0.60 CYP3A4 (1.00) CYP3A4ALDH1A1FTH1CYP2C9CYP2C19
3,7-Epoxycaryophyllan-6-Ol SCHEMBL24176356 0.60 CYP3A4 (1.00) CYP3A4ALDH1A1FTH1CYP2C9CYP2C19
SCHEMBL4272327 0.59 CYP3A4 (0.41) CYP3A4ALDH1A1USP2LMNAMAPT
SCHEMBL17857876 0.59 ALDH1A1 (0.39) CYP3A4ALDH1A1USP2LMNAMAPT
SCHEMBL11224933 0.58 CYP3A4 (0.33) CYP3A4
SCHEMBL9618702 0.57 ACHE (0.32) F10
SCHEMBL21475407 0.56 CYP3A4 (0.34) CYP3A4MAPT
SCHEMBL9589095 0.56 TP53 (0.39) CYP3A4LMNAMAPT

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
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-11-14 US disclosed
US-12098115-B2 Methods and compositions for terpenoid synthesis UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-09-24 US disclosed
US-11952327-B2 Methods and compositions for terpenoid synthesis UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-04-09 US disclosed
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2024-01-25 US disclosed
US-20190270700-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIV FLORIDA (US) 2019-09-05 US disclosed
WO-2018053322-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2018-03-22 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 (5 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-11952327-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS CYP3A4 11/4885ALDH1A1 1162/4885USP2 3951/4885
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS CYP3A4 11/4885ALDH1A1 1162/4885USP2 3951/4885
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS CYP3A4 11/4885ALDH1A1 1162/4885USP2 3951/4885
US-12098115-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS CYP3A4 11/4885ALDH1A1 1162/4885USP2 3951/4885
US-20190270700-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS CYP3A4 11/4885ALDH1A1 1353/4885USP2 4005/4885

“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.