SCHEMBL23277992

SCHEMBL23277992

CC(C)N1CCN(C[C@H](C)N)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.35
MAOB P27338 4/20 0.34
KDM1A O60341 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
PIK3CD O00329 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
CYP2D6 P10635 1/20 0.31
CHRNA7 P36544 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MC4R P32245 2/20 0.30

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
SCHEMBL27453236 1.00 DAO (0.35) DAOMAOBKDM1ASIGMAR1PIK3CD
SCHEMBL6680924 0.87
SCHEMBL1043849 0.87 PIK3CD (0.39) PIK3CDKDM4EALDH1A1CYP2D6MEN1
SCHEMBL991985 0.86 PIK3CD (0.33) PIK3CDMEN1KMT2A
SCHEMBL6124873 0.80 PIK3CD (0.50) DAOMAOBKDM1ASIGMAR1PIK3CD
SCHEMBL20959874 0.80 PIK3CD (0.50) PIK3CDALDH1A1CYP2D6
SCHEMBL27738215 0.79 PIK3CD (0.37) PIK3CD
SCHEMBL990333 0.78 GAA (0.36) PIK3CDKDM4EALDH1A1MAPTCHRNA7
SCHEMBL358504 0.78 GAA (0.41) PIK3CDKDM4EALDH1A1MAPTMEN1
SCHEMBL991278 0.78 GAA (0.41) PIK3CDKDM4EALDH1A1MAPTMEN1

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-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators GENENTECH, INC. (US) 2021-04-27 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-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators IRAK1, IRAK4, IRAK2 DAO 3303/4885MAOB 4248/4885KDM1A 359/4885

“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.