SCHEMBL25877850

SCHEMBL25877850

CC(C)CCCC(=O)N1C[C@H]2CC[C@@H](C1)N2

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 13/20 0.53
CHRNA3 P32297 13/20 0.53
CHRNA4 P43681 13/20 0.53
CHRNB3 Q05901 13/20 0.53
CHRNA6 Q15825 13/20 0.53
NPC1 O15118 1/20 0.40
FOS P01100 1/20 0.37
JUN P05412 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 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
SCHEMBL19335034 0.79 NPC1 (0.40) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL22794822 0.78 MEN1 (0.38) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL3805279 0.75 CHRNB2 (0.60) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL25914467 0.74 NPC1 (0.38) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL25877388 0.74 NPC1 (0.38) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL25123575 0.74 NPC1 (0.38) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL23696466 0.74 NPC1 (0.38) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL16186299 0.74 CHRNB2 (0.79) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL13667476 0.73 ATM (0.65) NPC1MEN1POLBMAPTKMT2A
SCHEMBL13970727 0.72 GNAI3 (0.44) NPC1MEN1KMT2AGNAI3GNAO1

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-11707457-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-07-25 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-11707457-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 CHRNB2 4503/4885CHRNA3 4431/4885CHRNA4 4510/4885

“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.