SCHEMBL20524919

SCHEMBL20524919

CC1(C)COc2c(C(=O)O)cccc21

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 9/20 0.52
PTGS2 P35354 9/20 0.52
ALOX5 P09917 5/20 0.45
BRD4 O60885 4/20 0.42
SCN4A P35499 1/20 0.38
SCN9A Q15858 1/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 1/20 0.38
RARA P10276 1/20 0.37
RARB P10826 1/20 0.37
RARG P13631 1/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
GFER P55789 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL21845248 0.85 PARP1 (0.49) PTGS1PTGS2ALOX5BRD4SCN4A
SCHEMBL21828706 0.84 HNF4A (0.44) PTGS1PTGS2BRD4SCN4ASCN9A
SCHEMBL22235420 0.80 PTGS1 (0.38) PTGS1PTGS2ALOX5BRD4ALDH1A1
SCHEMBL31566429 0.80 PTGS1 (0.38) PTGS1PTGS2ALOX5BRD4ALDH1A1
SCHEMBL9056358 0.78 PTGS1 (0.36) PTGS1PTGS2BRD4ALDH1A1ALOX15
SCHEMBL3456244 0.74 HPGD (0.52) PTGS1PTGS2ALOX5ALDH1A1ALOX15
SCHEMBL12678908 0.72 PTGS1 (0.38) PTGS1PTGS2ALOX5
SCHEMBL3307612 0.72 PTGS1 (0.38) PTGS1PTGS2ALOX5ALDH1A1MEN1
SCHEMBL3456240 0.72 NPC1 (0.46) MEN1KMT2A
SCHEMBL21845225 0.72 PARP1 (0.38) PTGS1PTGS2ALOX5ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3601291-B1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS INC (US) 2026-05-20 EP disclosed
US-11834456-B2 11,13-modified saxitoxins for the treatment of pain SITEONE THERAPEUTICS, INC. (US) 2023-12-05 US disclosed
CN-110831945-B 11, 13-modified saxitoxins for the treatment of pain 赛特温治疗公司 2023-08-08 CN disclosed
US-20220259218-A1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2022-08-18 US disclosed
US-11236097-B2 11,13-modified saxitoxins for the treatment of pain SITEONE THERAPEUTICS, INC. (US) 2022-02-01 US disclosed
US-20200102318-A1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2020-04-02 US disclosed
CN-110831945-A 11, 13-modified saxitoxins for the treatment of pain 赛特温治疗公司 2020-02-21 CN disclosed
EP-3601291-A1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN Siteone Therapeutics, Inc. (US) 2020-02-05 EP disclosed
WO-2018183781-A1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2018-10-04 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 (4 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-11236097-B2 11,13-modified saxitoxins for the treatment of pain SCN11A, SCN10A, CACNA1A PTGS1 843/4885PTGS2 1392/4885ALOX5 2930/4885
US-11834456-B2 11,13-modified saxitoxins for the treatment of pain SCN11A, SCN10A, CACNA1A PTGS1 843/4885PTGS2 1392/4885ALOX5 2930/4885
US-20220259218-A1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN SCN11A, SCN10A, CACNA1A PTGS1 843/4885PTGS2 1392/4885ALOX5 2930/4885
US-20200102318-A1 11,13-MODIFIED SAXITOXINS FOR THE TREATMENT OF PAIN SCN11A, SCN10A, CACNA1A PTGS1 843/4885PTGS2 1392/4885ALOX5 2930/4885

“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.