SCHEMBL19973074

SCHEMBL19973074

C=CCC(C#N)(C#N)C1=CCCCC1(CC=C)C(=O)OCC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.32
OPRM1 P35372 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
NR1H2 P55055 1/20 0.30
NR1H3 Q13133 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
SCHEMBL19983792 0.74
SCHEMBL19973058 0.71 ALDH1A1 (0.31) KCNA3OPRM1MEN1KMT2A
SCHEMBL31695088 0.68 CYP2C19 (0.39) OPRM1MEN1KMT2A
SCHEMBL5180173 0.68 CYP2C19 (0.39) OPRM1MEN1KMT2A
SCHEMBL25619136 0.67 CYP2C19 (0.36) MEN1KMT2A
SCHEMBL1137710 0.67 CYP2C19 (0.36) MEN1KMT2A
SCHEMBL7624802 0.66 CYP2C19 (0.35) MEN1KMT2A
SCHEMBL19973111 0.65
SCHEMBL20980165 0.65 POLB (0.41) OPRM1MEN1KMT2ANR1H2NR1H3
SCHEMBL20980138 0.65 ATM (0.40) MEN1KMT2A

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 KCNA3 1309/4885OPRM1 2046/4885MEN1 2816/4885
US-20240376041-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS KCNA3 1309/4885OPRM1 2046/4885MEN1 2816/4885
US-20240025843-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS KCNA3 1309/4885OPRM1 2046/4885MEN1 2816/4885
US-12098115-B2 Methods and compositions for terpenoid synthesis SQLE, GGPS1, LSS KCNA3 1309/4885OPRM1 2046/4885MEN1 2816/4885
US-20190270700-A1 METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS SQLE, GGPS1, LSS KCNA3 1267/4885OPRM1 2195/4885MEN1 2880/4885

“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.