SCHEMBL22522971

SCHEMBL22522971

CNC1CC(C(=O)Nc2ncc(C3CCOCC3)s2)C1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ CCNE1 P24864 8/20 0.43
▸ CDK2 P24941 8/20 0.43
▸ CDK5 Q00535 8/20 0.43
▸ CNR2 P34972 2/20 0.42
▸ CDK5R1 Q15078 1/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ UCHL1 P09936 1/20 0.40
▸ LCK P06239 1/20 0.38
▸ OGA O60502 2/20 0.38
▸ MKNK1 Q9BUB5 1/20 0.37
▸ NPC1 O15118 1/20 0.37

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
SCHEMBL22522759 0.87 SMN1; SMN2 (0.53) SMN1; SMN2CCNE1CDK2CDK5CDK5R1
SCHEMBL20877325 0.84 UCHL1 (0.45) SMN1; SMN2CCNE1CDK2CDK5CNR2
SCHEMBL20877327 0.84 UCHL1 (0.45) SMN1; SMN2CCNE1CDK2CDK5CNR2
SCHEMBL20883081 0.84 SMN1; SMN2 (0.59) SMN1; SMN2CCNE1CDK2CDK5CNR2
SCHEMBL22522925 0.82 GAA (0.40) SMN1; SMN2CCNE1CDK2CDK5CNR2
SCHEMBL20883082 0.80 UCHL1 (0.44) SMN1; SMN2CCNE1CDK2CDK5CNR2
SCHEMBL20883057 0.80 UCHL1 (0.44) SMN1; SMN2CCNE1CDK2CDK5CNR2
SCHEMBL22522948 0.79 SMN1; SMN2 (0.56) SMN1; SMN2CCNE1CDK2CDK5CDK5R1
SCHEMBL22523043 0.79 SMN1; SMN2 (0.56) SMN1; SMN2CCNE1CDK2CDK5CDK5R1
SCHEMBL22523014 0.78 SMN1; SMN2 (0.43) SMN1; SMN2CCNE1CDK2CDK5CDK5R1

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-20200317658-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 FORMA THERAPEUTICS, INC. 2020-10-08 — — 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-20200317658-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 30 USP30, UCHL1, UCHL3 SMN1; SMN2 88/4885CCNE1 3461/4885CDK2 1919/4885

“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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