SCHEMBL26140362

SCHEMBL26140362

CC(C)NC(=O)C1CN(C2CCN(C(C)(C)C)CC2)C1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.48
HTT P42858 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43
POLB P06746 2/20 0.43
ALDH1A1 P00352 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
GAA P10253 3/20 0.39
KDM4E B2RXH2 1/20 0.39
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 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
SCHEMBL24411761 0.87 SIGMAR1 (0.45) SIGMAR1HTTTSHRKMT2AMEN1
SCHEMBL23430752 0.85 KMT2A (0.58) SIGMAR1HTTTSHRKMT2AMEN1
SCHEMBL26138797 0.81 KMT2A (0.39) SIGMAR1KMT2AMEN1SMN1; SMN2LMNA
SCHEMBL11916124 0.78 SIGMAR1 (0.54) SIGMAR1KMT2AMEN1SMN1; SMN2LMNA
SCHEMBL24411744 0.75 SMN1; SMN2 (0.47) SIGMAR1TSHRKMT2AMEN1SMN1; SMN2
SCHEMBL26138869 0.74 EPHX2 (0.45) SIGMAR1KMT2AMEN1LMNAPOLB
SCHEMBL26138906 0.72 CHRM1 (0.31)
SCHEMBL23251485 0.72 SIGMAR1 (0.40) SIGMAR1HTTKMT2AMEN1LMNA
SCHEMBL25935524 0.72 OPRM1 (0.34) SIGMAR1
SCHEMBL24411694 0.71 POLB (0.53) HTTTSHRKMT2AMEN1SMN1; SMN2

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-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF GILEAD SCIENCES, INC. 2023-05-11 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-20230142629-A1 BIFUNCTIONAL DEGRADERS OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASES AND THERAPEUTIC USE THEREOF IRAK1, IRAK2, IRAK4 SIGMAR1 1670/4885HTT 2090/4885TSHR 2530/4885

“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.