SCHEMBL21361482

SCHEMBL21361482

COc1cccc(C(C)(C)c2ccc(C(C)C)c(OC)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
LPAR1 Q92633 2/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
TAAR1 Q96RJ0 2/20 0.36
MAPT P10636 2/20 0.36
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
KIF11 P52732 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ACHE P22303 1/20 0.36
P2RX3 P56373 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
SCHEMBL23252277 0.88 CCR6 (0.38) L3MBTL1MEN1CYP1A2CYP3A4CYP2C9
SCHEMBL20850496 0.86 SCN1A (0.38) MEN1KMT2ASCN1ASCN2ASCN3A
SCHEMBL20254372 0.84 NFE2L2 (0.36) L3MBTL1MEN1CYP1A2CYP3A4CYP2C9
SCHEMBL8408204 0.80 ACHE (0.52) CYP3A4ESR1ESR2TAAR1MAPT
SCHEMBL19700476 0.80 ESR1 (0.43) MEN1CYP3A4KMT2AESR1ESR2
SCHEMBL19923360 0.80 POLB (0.39) LPAR1ACHENPC1LMNARAB9A
SCHEMBL23344383 0.79 MAPT (0.40) L3MBTL1CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL10267465 0.77 NR1I2 (0.41) MEN1KMT2AHTTSMN1; SMN2CA1
SCHEMBL682768 0.75 CA12 (0.58) L3MBTL1MEN1CYP1A2CYP3A4CYP2C9
SCHEMBL15801259 0.74 GAA (0.39) L3MBTL1CYP3A4SCN1ASCN2ASCN3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-12-22 US disclosed
WO-2019178510-A1 TRIAZACYCLODODECANSULFONAMIDE (\"TCD\")-BASED PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-09-19 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-20220402891-A1 TRIAZACYCLODODECANSULFONAMIDE (TCD)-BASED PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G L3MBTL1 4748/4885MEN1 2318/4885CYP1A2 2446/4885

“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.