SCHEMBL23696161

SCHEMBL23696161

CCCCC(=O)N1CCC2(CCN(CC(C)C)CC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 12/20 0.58
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TSHR P16473 2/20 0.47
CYP2C9 P11712 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PIK3CD O00329 1/20 0.42
GNAI3 P08754 1/20 0.41
GNAI1 P63096 1/20 0.41
EPHX2 P34913 1/20 0.40

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
SCHEMBL23568284 0.91 CYP2D6 (0.61) CYP2D6ALDH1A1CYP3A4MAPK1SMN1; SMN2
SCHEMBL24672759 0.90 CYP2D6 (0.52) CYP2D6ALDH1A1CYP3A4TSHRCYP2C9
SCHEMBL25654337 0.88 CYP2D6 (0.52) CYP2D6ALDH1A1CYP3A4MAPK1SMN1; SMN2
SCHEMBL23471284 0.86 PIK3CD (0.58) L3MBTL1MEN1KMT2ATDP1PIK3CD
SCHEMBL25728641 0.86 CYP2D6 (0.50) CYP2D6ALDH1A1CYP3A4MAPK1SMN1; SMN2
SCHEMBL23560014 0.85 CYP2D6 (0.61) CYP2D6ALDH1A1CYP3A4MAPK1SMN1; SMN2
SCHEMBL25728592 0.85 CYP2D6 (0.50) CYP2D6TSHRCYP2C9L3MBTL1MEN1
SCHEMBL23806494 0.84 CYP2D6 (0.65) CYP2D6ALDH1A1CYP3A4MAPK1SMN1; SMN2
SCHEMBL25123000 0.83 L3MBTL1 (0.45) CYP2D6ALDH1A1CYP3A4L3MBTL1MEN1
SCHEMBL25924028 0.83 L3MBTL1 (0.42) CYP2D6ALDH1A1CYP3A4TSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023192586-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-10-05 WO disclosed
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
WO-2022125804-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 WO disclosed
US-20210228562-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2021-07-29 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 (2 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-20210228562-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CYP2D6 3599/4885ALDH1A1 2776/4885CYP3A4 2542/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CYP2D6 3599/4885ALDH1A1 2776/4885CYP3A4 2542/4885

“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.