SCHEMBL25825557

SCHEMBL25825557

CC(C)c1ccc(CS(=O)(=O)C(C)C)cn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 2/20 0.38
CHRNA7 P36544 1/20 0.37
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
APLNR P35414 3/20 0.33
CACNA1I Q9P0X4 2/20 0.32
SLC22A12 Q96S37 1/20 0.32
CACNA1G O43497 1/20 0.32
CACNA1H O95180 1/20 0.32
CNR2 P34972 1/20 0.32
KCNH2 Q12809 1/20 0.32
CPB2 Q96IY4 1/20 0.31
LIPG Q9Y5X9 3/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
PIK3CA P42336 1/20 0.30

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
SCHEMBL23114318 0.84 CHRNA7 (0.40) PANK3CHRNA7ESR1ESR2NR1H2
SCHEMBL24837402 0.81 ESR1 (0.38) PANK3CHRNA7ESR1ESR2NR1H2
SCHEMBL25820317 0.75 CHRNA7 (0.39) CHRNA7NR1H2ALOX5APFEN1PIK3CA
SCHEMBL5513354 0.74 GABRP (0.56) PANK3ESR1ESR2SLC22A12CPB2
SCHEMBL24760247 0.74 PANK3 (0.47) PANK3ESR1ESR2NR1H2NR1H3
SCHEMBL5513086 0.74 KDM4E (0.43) PANK3ESR1ESR2PRMT5WDR77
SCHEMBL21267702 0.73 KMT2A (0.45) CHRNA7NR1H2NR1H3CNR2
SCHEMBL20994112 0.73 ESR1 (0.39) PANK3CHRNA7ESR1ESR2NR1H2
SCHEMBL24760211 0.72 PANK3 (0.46) PANK3ESR1ESR2PRMT5WDR77
Hydrochloric Acid SCHEMBL29268002 0.72 GABRP (0.54) PANK3ESR1ESR2SLC22A12CPB2

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-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR PANK3 96/4885CHRNA7 4724/4885ESR1 1847/4885

“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.