SCHEMBL24673650

SCHEMBL24673650

CCC(C)CN1CCC2(CC1)CN(CC)C2

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
CYP2D6 P10635 12/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP3A4 P08684 5/20 0.33
CYP1A2 P05177 4/20 0.33
USP2 O75604 3/20 0.33
CYP2C9 P11712 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP2C19 P33261 1/20 0.31
VNN1 O95497 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL22856361 0.85 CYP2D6 (0.51) TSHRCYP2D6SMN1; SMN2CYP3A4CYP1A2
SCHEMBL24508472 0.83 CYP2D6 (0.37) TSHRCYP2D6SMN1; SMN2CYP3A4CYP1A2
SCHEMBL22305065 0.80 TSHR (0.53) TSHRCYP2D6CYP3A4
SCHEMBL25728844 0.78 DRD2 (0.33) CYP2D6SMN1; SMN2
SCHEMBL10289113 0.78 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL15221484 0.77 TSHR (0.61) TSHRCYP2D6CYP3A4VNN1
SCHEMBL23842142 0.77 CYP2D6 (0.32) TSHRCYP2D6
SCHEMBL24250659 0.77 TSHR (0.49) TSHRCYP2D6SMN1; SMN2CYP3A4CYP1A2
SCHEMBL23560331 0.77 CYP2D6 (0.48) TSHRCYP2D6SMN1; SMN2CYP3A4CYP1A2
SCHEMBL25924590 0.76 CYP2D6 (0.37) CYP2D6SMN1; SMN2CYP3A4ALDH1A1

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-20220340570-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2022-10-27 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-20220340570-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 TSHR 3319/4885CYP2D6 3599/4885SMN1; SMN2 2647/4885

“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.