SCHEMBL19915505

SCHEMBL19915505

CCCC[C@@]1(C)C(C)=CC(=O)c2cc(C(C)C)c(OC)cc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC10A2 Q12908 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TOP1 P11387 4/20 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
SCHEMBL11316196 0.62 HSD17B10 (0.34) MAPTHSD17B10
SCHEMBL12715260 0.62 RXRA (0.43) POLBMAPTTSHRGAAGFER
SCHEMBL2953510 0.59 GAA (0.59) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL19308587 0.59 GAA (0.47) POLBTSHRGAAGFERMEN1
SCHEMBL12425507 0.59 POLB (0.56) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL24413823 0.58 GAA (0.47) POLBMAPTTSHRGAAGFER
SCHEMBL17862081 0.58 TAAR1 (0.59) POLBGAAGFER
SCHEMBL13351579 0.58 TAAR1 (0.55) POLBGAAGFERMEN1ALDH1A1
SCHEMBL12889915 0.57 GAA (0.57) POLBMAPTHPGDTSHRHSD17B10
SCHEMBL16499589 0.57 SOD1 (0.43) POLBMAPTHPGDTSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10464963-B2 Compounds from invasive Salvinias and methods of using the same STEPHEN F. AUSTIN STATE UNIVERSITY (US) 2019-11-05 — — US disclosed
US-20180057524-A1 COMPOUNDS FROM INVASIVE SALVINIAS AND METHODS OF USING THE SAME STEPHEN F. AUSTIN STATE UNIVERSITY 2018-03-01 — — 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 (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-10464963-B2 Compounds from invasive Salvinias and methods of using the same MMP8, GUSB, MMP9 SLC10A2 213/4885POLB 2331/4885MAPT 4354/4885
US-20180057524-A1 COMPOUNDS FROM INVASIVE SALVINIAS AND METHODS OF USING THE SAME MMP8, GUSB, MMP9 SLC10A2 213/4885POLB 2331/4885MAPT 4354/4885

“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.

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