SCHEMBL23807345

SCHEMBL23807345

CN(CCCOCCCN(C)C(=O)c1ccc(CNCc2ccc(-c3ccc4c(cnn4CC4CC4)c3)cc2)cc1)CC1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.36
BRD4 O60885 2/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.35
GCGR P47871 1/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
ITK Q08881 1/20 0.34
S1PR1 P21453 3/20 0.34
CNR1 P21554 2/20 0.33
PDE7A Q13946 1/20 0.33
HTR5A P47898 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC6A4 P31645 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
SCHEMBL23806553 0.90 GCGR (0.43) BRD4HDAC1HDAC2GCGRITK
SCHEMBL23807102 0.82 GCGR (0.39) BRD4HDAC1HDAC2GCGRRXRA
SCHEMBL23807637 0.82 GCGR (0.37) CNR2BRD4HDAC1HDAC2GCGR
SCHEMBL23788113 0.77 HDAC1 (0.46) BRD4HDAC1HDAC2RXRARXRB
SCHEMBL23945589 0.77 HDAC1 (0.47) BRD4HDAC1HDAC2HDAC8RXRA
SCHEMBL23788065 0.76 HDAC1 (0.48) BRD4HDAC1HDAC2HDAC8RXRA
SCHEMBL23806478 0.75 HDAC1 (0.45) BRD4HDAC1HDAC2HDAC8GCGR
SCHEMBL23807111 0.70 BRD4 (0.42) BRD4HDAC1HDAC2HDAC8RXRA
SCHEMBL21996985 0.69 HDAC1 (0.43) BRD4HDAC1HDAC2HDAC8RXRA
SCHEMBL21997736 0.66 HDAC1 (0.41) BRD4HDAC1HDAC2HDAC8GCGR

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-11117889-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2021-09-14 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-11117889-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 CNR2 2856/4885BRD4 132/4885HDAC1 502/4885

“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.