SCHEMBL25570904

SCHEMBL25570904

CCCN1CC[C@@H](C(=O)NC(C)C)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TSHR P16473 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HTT P42858 1/20 0.45
KDM2B Q8NHM5 2/20 0.44
POLB P06746 1/20 0.43
ACHE P22303 1/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL25570176 1.00 BCHE (0.49) BCHESMN1; SMN2TSHRMEN1KMT2A
SCHEMBL25570418 0.90 SMN1; SMN2 (0.55) SMN1; SMN2TSHRMEN1KMT2AHTT
SCHEMBL25568046 0.88 TSHR (0.49) BCHESMN1; SMN2TSHRMEN1KMT2A
SCHEMBL25568049 0.88 TSHR (0.49) BCHESMN1; SMN2TSHRMEN1KMT2A
SCHEMBL20381996 0.87 SMN1; SMN2 (0.51) BCHESMN1; SMN2TSHRMEN1KMT2A
SCHEMBL13102172 0.81 BCHE (0.65) BCHESMN1; SMN2KDM2BKDM4E
SCHEMBL20962701 0.80 SMN1; SMN2 (0.58) SMN1; SMN2TSHRMEN1KMT2AHTT
SCHEMBL21486158 0.79 TSHR (0.57) BCHESMN1; SMN2TSHRMEN1KMT2A
SCHEMBL25568041 0.79 MEN1 (0.54) SMN1; SMN2TSHRMEN1KMT2AHTT
SCHEMBL14883715 0.78 KMT2A (0.56) SMN1; SMN2TSHRMEN1KMT2AHTT

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-20230167105-A1 BCL-2 PROTEIN INHIBITORS RECURIUM IP HOLDINGS, LLC 2023-06-01 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-20230167105-A1 BCL-2 PROTEIN INHIBITORS BCL2, BCL2L1, BCL2L2 BCHE 4288/4885SMN1; SMN2 2010/4885TSHR 3849/4885

“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.