SCHEMBL29333971

SCHEMBL29333971

CC(C)(C)C1CCCCN(S(C)(=O)=O)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.41
MAPK1 P28482 2/20 0.39
ATM Q13315 1/20 0.37
GAA P10253 2/20 0.35
LMNA P02545 1/20 0.35
CYP2C19 P33261 1/20 0.35
GLA P06280 1/20 0.35
POLB P06746 2/20 0.34
ALOX15 P16050 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
FABP6 P51161 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL9917274 0.94 TSHR (0.45) ALDH1A1TSHRMAPK1GAACYP2C19
SCHEMBL24619078 0.94 TSHR (0.45) ALDH1A1TSHRMAPK1GAACYP2C19
SCHEMBL2625515 0.86 TP53 (0.39) ALDH1A1TSHRMAPK1ATMGAA
SCHEMBL1104713 0.86 TP53 (0.39) ALDH1A1TSHRMAPK1ATMGAA
SCHEMBL12384404 0.86 TP53 (0.39) ALDH1A1TSHRMAPK1ATMGAA
SCHEMBL18745363 0.80 TSHR (0.43) ALDH1A1TSHRMAPK1GAACYP2C19
SCHEMBL13225930 0.79 FABP6 (0.43) ALDH1A1TSHRMAPK1ATMGAA
SCHEMBL15177622 0.78 PAX8 (0.32) ALDH1A1TSHRATM
SCHEMBL21936034 0.77 GAA (0.42) ALDH1A1TSHRMAPK1ATMGAA
SCHEMBL18531901 0.74 EPHX1 (0.36) ALDH1A1TSHRMAPK1GAALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF ASIA VISION LIMITED (CN) 2024-07-18 US 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-20240239792-A1 MODULATORS OF BCL-2 OR BCL-2/BCL-XL AND USES THEREOF BCL2, BCL2L2, BCL2L1 ALDH1A1 3682/4885TSHR 3700/4885MAPK1 1739/4885

“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.