SCHEMBL13833735

SCHEMBL13833735

CCN1CCC(=O)C(O)C1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.33
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
CYP2D6 P10635 1/20 0.32
LMNA P02545 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL10256918 0.78 LMNA (0.49) KMT2ASMN1; SMN2MAPTLMNACHRM2
SCHEMBL11234523 0.76 LMNA (0.32) LMNA
SCHEMBL23002177 0.76 ITGB3 (0.35) SMN1; SMN2KDM4EALDH1A1CYP2D6CHRM2
Hydrochloric Acid SCHEMBL442313 0.74 CYP3A4 (0.35) SMN1; SMN2KDM4EALDH1A1CYP2D6LMNA
SCHEMBL22036801 0.72 LMNA (0.30) LMNA
SCHEMBL938094 0.69 GAA (0.42) KMT2AGAASMN1; SMN2KDM4EMEN1
SCHEMBL17722609 0.69 ALDH1A1 (0.34) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL12801362 0.68 NOTUM (0.38) SMN1; SMN2KDM4EALDH1A1MAPTSIGMAR1
SCHEMBL25045013 0.68 CA1 (0.43) KMT2ASMN1; SMN2CYP2D6LMNACHRM2
SCHEMBL2836553 0.67 GRIN2B (0.41) KMT2AGRIN1GRIN2BSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. 2013-03-21 US disclosed
US-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. 2013-03-21 US disclosed
WO-2012154888-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. (US) 2012-11-15 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-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS HSPA5, PSMG3, VCP KMT2A 4747/4885GAA 335/4885SMN1; SMN2 297/4885

“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.