SCHEMBL25923737

SCHEMBL25923737

CC(C)CN1CCC(CNS)CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP2D6 P10635 3/20 0.37
KCNH2 Q12809 4/20 0.36
CACNA1I Q9P0X4 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33
HTT P42858 1/20 0.32

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
SCHEMBL23568463 0.84 L3MBTL1 (0.44) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL22856529 0.82 KDM4E (0.39) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL23841859 0.81 KCNH2 (0.40) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL25691521 0.79 PIK3CD (0.43) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL21107430 0.79 PIK3CD (0.43) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL25828843 0.78 CYP2D6 (0.46) PIK3CDALDH1A1CYP2D6SMN1; SMN2
SCHEMBL1687229 0.77 PIK3CD (0.42) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL1621207 0.77 PIK3CD (0.42) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL13683795 0.75 PIK3CD (0.44) PIK3CDKDM4EALDH1A1TDP1CYP2D6
SCHEMBL599158 0.75 NCF1 (0.52) PIK3CDKDM4EALDH1A1TDP1CYP2D6

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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-07-27 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-20230234953-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PIK3CD 321/4885KDM4E 190/4885ALDH1A1 2776/4885

“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.