SCHEMBL24636780

SCHEMBL24636780

CC(C)c1c(O)cc(Cl)c(Cl)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 9/20 0.52
TSHR P16473 8/20 0.52
HPGD P15428 7/20 0.52
CYP3A4 P08684 7/20 0.52
HSP90AA1 P07900 2/20 0.52
MAPK1 P28482 3/20 0.41
ALOX15 P16050 3/20 0.41
ALOX12 P18054 2/20 0.41
LMNA P02545 2/20 0.41
AKR1B1 P15121 1/20 0.40
ALDH1A1 P00352 2/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
CASP1 P29466 1/20 0.39
AHR P35869 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
TDP1 Q9NUW8 1/20 0.34
MCL1 Q07820 2/20 0.32
BCL2 P10415 1/20 0.32

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
SCHEMBL18112482 0.80 CYP3A4 (0.53) HSD17B10TSHRHPGDCYP3A4HSP90AA1
SCHEMBL23236496 0.80 LMNA (0.48) HSD17B10HPGDCYP3A4MAPK1ALOX15
SCHEMBL25008863 0.78 GABRA1 (0.36) HSD17B10CYP3A4ALOX15ALOX12LMNA
SCHEMBL23079373 0.77 GABRA1 (0.41) HSD17B10TSHRHPGDCYP3A4HSP90AA1
SCHEMBL26772964 0.77 ALOX15 (0.39) HSD17B10TSHRHPGDCYP3A4HSP90AA1
SCHEMBL26772981 0.77 HPGD (0.42) HSD17B10TSHRHPGDCYP3A4HSP90AA1
SCHEMBL13748754 0.74 TSHR (0.52) HSD17B10TSHRHPGDCYP3A4HSP90AA1
SCHEMBL7033501 0.73 LMNA (0.45) HSD17B10TSHRHPGDALOX15ALOX12
SCHEMBL24838149 0.73 GABRA1 (0.48) HSD17B10TSHRHPGDCYP3A4ALOX15
SCHEMBL23226978 0.73 CYP3A4 (0.52) HSD17B10TSHRCYP3A4MAPK1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373952-A1 LACTAM COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC 2023-11-23 US disclosed
US-20230373952-A1 LACTAM COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC 2023-11-23 US disclosed
US-20230026611-A1 ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC 2023-01-26 US disclosed
WO-2022212296-A1 ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D.E. SHAW RESEARCH, LLC (US) 2022-10-06 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 (2 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-20230026611-A1 ARYL HETEROCYCLIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS KCNA3, KCNH2, KCNJ2 HSD17B10 1230/4885TSHR 1706/4885HPGD 2935/4885
US-20230373952-A1 LACTAM COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS KCNK3, KCNA3, KCNJ2 HSD17B10 1201/4885TSHR 3212/4885HPGD 3767/4885

“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.