SCHEMBL954706

SCHEMBL954706

COc1[c]ccc(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KIF11 P52732 1/20 0.32
MAPT P10636 3/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
TP53 P04637 1/20 0.30
ALPL P05186 1/20 0.30
TSHR P16473 1/20 0.30
GAK O14976 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
SCHEMBL8135398 0.84 CYP11B1 (0.31) CA1CA2
SCHEMBL5054248 0.82 TSHR (0.34) TSHR
SCHEMBL160761 0.82 L3MBTL1 (0.37) ALDH1A1HPGDHSD17B10KIF11MAPT
SCHEMBL28826291 0.80 CYP19A1 (0.34)
SCHEMBL2767797 0.79 ALDH1A1 (0.31) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL5477987 0.79 ALDH1A1 (0.34) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL28088212 0.77 ACHE (0.40) ALDH1A1HPGDHSD17B10TDP1KIF11
SCHEMBL27660860 0.74 KDM4E (0.33) HSD17B10MAPTRECQL
SCHEMBL14054015 0.74 ATM (0.30)
SCHEMBL4858324 0.73 CYP3A4 (0.33) ALDH1A1HSD17B10TDP1TSHR

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115297861-B Compounds and uses thereof 福宏治疗公司 2024-07-12 CN claimed
US-20230145003-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-11 US claimed
US-20220000877-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. BRAUN MELSUNGEN AG (DE) 2022-01-06 US claimed
US-20210401848-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. BRAUN MELSUNGEN AG (DE) 2021-12-30 US claimed
EP-3886804-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. Braun Melsungen AG (DE) 2021-10-06 EP claimed
EP-3886805-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. Braun Melsungen AG (DE) 2021-10-06 EP claimed
CN-113347960-A Aqueous composition, in particular for the treatment of mucous membranes and/or wounds B.布劳恩梅尔松根股份公司 2021-09-03 CN claimed
CN-113271924-A Aqueous composition, in particular for the treatment of mucous membranes and/or wounds B.布劳恩梅尔松根股份公司 2021-08-17 CN claimed
CN-115297861-B Compounds and uses thereof 福宏治疗公司 2024-07-12 CN disclosed
US-20230145003-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-11 US disclosed
CN-115297861-A Compound and use thereof 福宏治疗公司 2022-11-04 CN disclosed
US-20220000877-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. BRAUN MELSUNGEN AG (DE) 2022-01-06 US disclosed
US-20210401848-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. BRAUN MELSUNGEN AG (DE) 2021-12-30 US disclosed
EP-3886805-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS B. Braun Melsungen AG (DE) 2021-10-06 EP disclosed
EP-0882724-B1 CYCLIC PHENOL SULFIDE CONTAINING SULFINYL OR SULFONYL GROUP AND PROCESS FOR PREPARING THE SAME COSMO RES INST (JP) 2001-11-07 EP disclosed
EP-0731102-B1 Cyclic phenol sulfide and process for producing the same COSMO RES INST (JP) 2001-11-07 EP disclosed
US-5998631-A Cyclic phenol sulfide having at least one sulfinyl or sulfonyl group and process for producing the same COSMO RESEARCH INSTITUTE (JP) 1999-12-07 US disclosed
EP-0882724-A1 CYCLIC PHENOL SULFIDE CONTAINING SULFINYL OR SULFONYL GROUP AND PROCESS FOR PREPARING THE SAME COSMO RESEARCH INSTITUTE (JP) 1998-12-09 EP disclosed
US-5824808-A Cyclic phenol sulfide and process for producing the same COSMO RESEARCH INSTITUTE (JP) 1998-10-20 US disclosed
EP-0731102-A1 Cyclic phenol sulfide and process for producing the same COSMO RESEARCH INSTITUTE (JP) 1996-09-11 EP 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 (3 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-20220000877-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS MUC1, DSG1, AQP3 ALDH1A1 3087/4885HPGD 2138/4885ALOX15 3168/4885
US-20230145003-A1 COMPOUNDS AND USES THEREOF VHL, CLN6, TFEB ALDH1A1 2571/4885HPGD 3705/4885ALOX15 3537/4885
US-20210401848-A1 AQUEOUS COMPOSITION, IN PARTICULAR FOR TREATING MUCOSA AND/OR WOUNDS DSP, DSG1, MUC1 ALDH1A1 2335/4885HPGD 2395/4885ALOX15 2654/4885

“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.