SCHEMBL19625411

SCHEMBL19625411

CCN(CC)Cc1cccc(-c2csc(C(C)(C)C)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.46
▸ ATP4A P20648 4/20 0.46
▸ ATP4B P51164 4/20 0.46
▸ GFER P55789 1/20 0.42
▸ TSHR P16473 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ NMT1 P30419 5/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ AOC3 Q16853 1/20 0.38
▸ COMT P21964 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ACP1 P24666 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ LTA4H P09960 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
SCHEMBL19625399 0.87 ATP4A (0.59) PRMT6ATP4AATP4BGFERTSHR
SCHEMBL19625374 0.79 GFER (0.43) PRMT6ATP4AATP4BGFERTSHR
SCHEMBL12868318 0.76 ATP4A (0.55) PRMT6ATP4AATP4BTSHRRECQL
SCHEMBL19627033 0.76 GFER (0.41) PRMT6ATP4AATP4BGFERTSHR
SCHEMBL19625383 0.74 SMN1; SMN2 (0.46) PRMT6ATP4AATP4BGFERTSHR
SCHEMBL19625323 0.74 RAB9A (0.50) ATP4AATP4BTSHR
SCHEMBL12293307 0.74 CYP19A1 (0.55) ATP4AATP4BTSHRRECQL
SCHEMBL19625319 0.74 MAPT (0.62) PRMT6TSHRRECQLL3MBTL1COMT
SCHEMBL19625325 0.74 KDM4E (0.62) TSHRRECQLL3MBTL1COMT
SCHEMBL799900 0.72 ALDH1A1 (0.55) ATP4AATP4BGFERLMNA

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-20170334912-A1 Purine Diones As Wnt Pathway Modulators AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-11-23 — — 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-20170334912-A1 Purine Diones As Wnt Pathway Modulators WNT1, WNT3A, CTNNB1 PRMT6 1600/4885ATP4A 1734/4885ATP4B 1169/4885

“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.

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