SCHEMBL24293377

SCHEMBL24293377

COc1c(Cl)ccc(Cl)c1C(=O)OCCN

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.66
▸ TSHR P16473 1/20 0.66
▸ KDM4E B2RXH2 2/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ TAS1R3 Q7RTX0 7/20 0.46
▸ TAS1R1 Q7RTX1 7/20 0.46
▸ TAS1R2 Q8TE23 5/20 0.45
▸ MAPT P10636 2/20 0.38
▸ GAA P10253 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PLAU P00749 2/20 0.36
▸ IDO1 P14902 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
Hydrochloric Acid SCHEMBL29433242 0.98 ALDH1A1 (0.64) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL3779532 0.91 ALDH1A1 (0.59) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL24293373 0.91 ALDH1A1 (0.62) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL29786135 0.90 ALDH1A1 (0.73) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL27198368 0.90 ALDH1A1 (0.73) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
Hydrochloric Acid SCHEMBL26646529 0.90 ALDH1A1 (0.61) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
Trimethylammonium SCHEMBL1701713 0.86 ALDH1A1 (0.68) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL25397182 0.86 ALDH1A1 (0.68) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL21318173 0.86 ALDH1A1 (0.68) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2
SCHEMBL29786129 0.86 ALDH1A1 (0.68) ALDH1A1TSHRKDM4EHSD17B10SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365493-A1 COMPOUNDS AND METHODS DemAgtech Pty Ltd (AU) 2023-11-16 — — US disclosed
US-20230365493-A1 COMPOUNDS AND METHODS DemAgtech Pty Ltd (AU) 2023-11-16 — — US disclosed
US-20230365493-A1 COMPOUNDS AND METHODS DemAgtech Pty Ltd (AU) 2023-11-16 — — US disclosed
WO-2023168484-A1 \"COMPOUNDS AND METHODS\ DemAgtech Pty Ltd (AU) 2023-09-14 — — WO disclosed
WO-2023168484-A1 \"COMPOUNDS AND METHODS\ DemAgtech Pty Ltd (AU) 2023-09-14 — — WO disclosed
EP-4211108-A1 COMPOUNDS AND METHODS Demagtech Pty Ltd (AU) 2023-07-19 — — EP disclosed
WO-2022051804-A1 COMPOUNDS AND METHODS THE UNIVERSITY OF WESTERN AUSTRALIA (AU) 2022-03-17 — — WO disclosed
WO-2022051804-A1 COMPOUNDS AND METHODS THE UNIVERSITY OF WESTERN AUSTRALIA (AU) 2022-03-17 — — 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-20230365493-A1 COMPOUNDS AND METHODS DDT, CYP19A1, CYP1A1 ALDH1A1 86/4885TSHR 2347/4885KDM4E 1979/4885

“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.

Send feedback