SCHEMBL21725302

SCHEMBL21725302

CCC(C)N1CCC(CNC(C)CO)C1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
DUSP3 P51452 1/20 0.30
PTPN5 P54829 1/20 0.30
PTPN11 Q06124 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
SCHEMBL19098401 0.86 LMNA (0.33) LMNASMN1; SMN2HTTKMT2AALDH1A1
SCHEMBL24713145 0.79 LMNA (0.34) LMNASMN1; SMN2HTTALDH1A1MAPT
SCHEMBL19098405 0.79 NCF1 (0.35) HTTKMT2A
SCHEMBL19122629 0.78 CHRM3 (0.35) SMN1; SMN2KMT2A
SCHEMBL19083172 0.78 SIGMAR1 (0.33) LMNASMN1; SMN2HTTALDH1A1MAPT
SCHEMBL22096795 0.73 LMNA (0.42) LMNASMN1; SMN2ALDH1A1
SCHEMBL22857058 0.72 SMN1; SMN2 (0.39) LMNASMN1; SMN2HTTALDH1A1MAPT
SCHEMBL20714635 0.72
SCHEMBL15504870 0.72
SCHEMBL22778615 0.72 NCF1 (0.42) HTT

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-10562909-B2 Fused quadracyclic compounds, compositions and uses thereof Tabomedex Biosciences, LLC (US) 2020-02-18 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-10562909-B2 Fused quadracyclic compounds, compositions and uses thereof MKNK2, CYP2J2, PTGS2 LMNA 4393/4885SMN1; SMN2 4269/4885HTT 3702/4885

“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.