SCHEMBL22909056

SCHEMBL22909056

CCOC(=O)c1sc2cccc(OC)c2c1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.55
KDM4E B2RXH2 7/20 0.55
GAA P10253 6/20 0.55
HPGD P15428 5/20 0.55
HSD17B10 Q99714 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAPK1 P28482 2/20 0.55
GLA P06280 1/20 0.55
TSHR P16473 1/20 0.55
MAPT P10636 6/20 0.55
LMNA P02545 6/20 0.55
NPSR1 Q6W5P4 2/20 0.55
NPC1 O15118 4/20 0.52
KMT2A Q03164 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
MEN1 O00255 3/20 0.52
RAB9A P51151 3/20 0.52
USP2 O75604 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
HTT P42858 1/20 0.51

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
SCHEMBL29513048 1.00 ALDH1A1 (0.55) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL23112007 0.89 ALDH1A1 (0.55) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL11101251 0.87 BACE1 (0.54) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL22909057 0.84 MAPT (0.54) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL22909058 0.84 ALDH1A1 (0.51) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL29513197 0.84 MAPT (0.54) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL29513181 0.84 ALDH1A1 (0.51) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL26049470 0.83 LMNA (0.44) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL10744393 0.83 ALDH1A1 (0.58) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL29513081 0.83 ALDH1A1 (0.58) ALDH1A1KDM4EGAAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112424181-B Substituted condensed thiophenes as STING modulators 希泰克斯特私人有限公司 2024-02-27 CN disclosed
EP-3793988-B1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING CTXT PTY LTD (AU) 2023-11-15 EP disclosed
EP-3999185-B1 BENZOTHIOPHENE, THIENOPYRIDINE AND THIENOPYRIMIDINE DERIVATIVES FOR THE MODULATION OF STING CTXT PTY LTD (AU) 2023-08-30 EP disclosed
US-20230227423-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING CTXT PTY LTD (AU) 2023-07-20 US disclosed
US-20230227423-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING CTXT PTY LTD (AU) 2023-07-20 US disclosed
US-20220389032-A1 BENZOTHIOPHENE, THIENOPYRIDINE AND THIENOPYRIMIDINE DERIVATIVES FOR THE MODULATION OF STING CTXT PTY LTD. (AU) 2022-12-08 US disclosed
CN-114206882-A Benzothiophene, thienopyridine, and thienopyrimidine derivatives for modulation of STING CTXT私人有限公司 2022-03-18 CN disclosed
US-20210214333-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING CTXT PTY LTD. (AU) 2021-07-15 US disclosed
CN-112424181-A Substituted condensed thiophenes as STING modulators 希泰克斯特私人有限公司 2021-02-26 CN disclosed
WO-2021009365-A1 BENZOTHIOPHENE, THIENOPYRIDINE AND THIENOPYRIMIDINE DERIVATIVES FOR THE MODULATION OF STING CTXT PTY LIMITED (AU) 2021-01-21 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 (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-20230227423-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING STING1, CGAS, IRF3 ALDH1A1 4660/4885KDM4E 1469/4885GAA 3682/4885
US-20210214333-A1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING STING1, CGAS, IRF3 ALDH1A1 4719/4885KDM4E 1519/4885GAA 3807/4885
US-20220389032-A1 BENZOTHIOPHENE, THIENOPYRIDINE AND THIENOPYRIMIDINE DERIVATIVES FOR THE MODULATION OF STING STING1, CGAS, MAVS ALDH1A1 3516/4885KDM4E 1256/4885GAA 3648/4885

“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.