SCHEMBL25829191

SCHEMBL25829191

CCCCCC(CCCC)CN1CCC2(CC1)CCN(C(=O)CCC(C)CCC)CC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 9/20 0.40
OPRL1 P41146 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 1/20 0.36
GNAI3 P08754 1/20 0.34
GNAI1 P63096 1/20 0.34
MAPK1 P28482 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33

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
SCHEMBL26408734 0.96 CYP2D6 (0.40) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL23945421 0.95 OPRL1 (0.39) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL24673399 0.91 CYP2D6 (0.41) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL25887973 0.88 CYP2D6 (0.41) CYP2D6L3MBTL1MEN1KMT2ATDP1
SCHEMBL23945726 0.87 CYP2D6 (0.37) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL25123000 0.87 L3MBTL1 (0.45) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL25707713 0.87 L3MBTL1 (0.49) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL23946030 0.87 L3MBTL1 (0.49) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL25833307 0.86 CYP2D6 (0.40) CYP2D6OPRL1L3MBTL1MEN1KMT2A
SCHEMBL25887917 0.86 L3MBTL1 (0.38) CYP2D6OPRL1L3MBTL1MEN1KMT2A

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-20230219945-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-13 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-20230219945-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 CYP2D6 3599/4885OPRL1 2347/4885L3MBTL1 1394/4885

“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.