SCHEMBL22909024

SCHEMBL22909024

CCOC(=O)c1sc2ccccc2c1CBr

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.59
LMNA P02545 4/20 0.59
KMT2A Q03164 3/20 0.59
NOD2 Q9HC29 1/20 0.56
MAPT P10636 9/20 0.56
GAA P10253 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
PLK1 P53350 1/20 0.52
TP53 P04637 2/20 0.51
RXFP1 Q9HBX9 1/20 0.49
GABRP O00591 1/20 0.49
GABRD O14764 1/20 0.49
GABRA1 P14867 1/20 0.49
GABRB1 P18505 1/20 0.49
GABRG2 P18507 1/20 0.49
GABRB3 P28472 1/20 0.49
GABRA5 P31644 1/20 0.49
GABRA3 P34903 1/20 0.49
GABRA2 P47869 1/20 0.49

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
SCHEMBL29513021 1.00 ALDH1A1 (0.59) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL1269967 0.85 LMNA (0.63) ALDH1A1LMNAKMT2AMAPTGAA
SCHEMBL6759279 0.84 ALDH1A1 (0.57) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL10566048 0.84 ALDH1A1 (0.57) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL23218561 0.82 KMT2A (0.47) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL29513035 0.82 ALDH1A1 (0.64) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL9025206 0.82 ALDH1A1 (0.64) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL6660225 0.81 MAPT (0.46) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL4633547 0.81 ALDH1A1 (0.63) ALDH1A1LMNAKMT2ANOD2MAPT
SCHEMBL9495721 0.81 LMNA (0.65) ALDH1A1LMNAKMT2ANOD2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 (1 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 4660/4885LMNA 3433/4885KMT2A 1206/4885

“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.