SCHEMBL26460801

SCHEMBL26460801

CC(C)N1CCC2(CC1)NC(=O)CNC2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OTUD7B Q6GQQ9 1/20 0.51
CDK8 P49336 1/20 0.38
CDK19 Q9BWU1 1/20 0.38
NEK2 P51955 2/20 0.34
CYP2D6 P10635 1/20 0.34
KMT2A Q03164 2/20 0.33
TOP2A P11388 2/20 0.33
TOP2B Q02880 2/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
PARP1 P09874 1/20 0.32
DAO P14920 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
BLM P54132 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 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
SCHEMBL14377201 0.81 OTUD7B (0.55) OTUD7BCDK8CDK19NEK2KDM4E
SCHEMBL1508957 0.78 OTUD7B (0.53) OTUD7BCDK8CDK19NEK2
SCHEMBL7883805 0.77 CRBN (0.45) CYP2D6
SCHEMBL9963246 0.76 CYP2D6 (0.36) OTUD7BCDK8CDK19CYP2D6KMT2A
SCHEMBL20437872 0.75 CYP2D6 (0.35) OTUD7BCYP2D6KMT2ATOP2ATOP2B
SCHEMBL21715595 0.74 OTUD7B (0.50) OTUD7BCDK8CDK19NEK2
SCHEMBL31421433 0.73 OTUD7B (0.51) OTUD7BCDK8CDK19NEK2
SCHEMBL30239594 0.72 OTUD7B (0.49) OTUD7BCDK8CDK19NEK2KMT2A
SCHEMBL606993 0.71 NEK2 (0.48) OTUD7BCDK8CDK19NEK2
SCHEMBL18925948 0.69 CYP2D6 (0.39) NEK2CYP2D6KMT2ATOP2ATOP2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230125684-A1 Aryl Sulfonyl Compounds as CCR6 Inhibitors CHEMOCENTRYX, INC. 2023-04-27 US disclosed
US-20230125684-A1 Aryl Sulfonyl Compounds as CCR6 Inhibitors CHEMOCENTRYX, INC. 2023-04-27 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-20230125684-A1 Aryl Sulfonyl Compounds as CCR6 Inhibitors CCR6, CCR1, CCR3 OTUD7B 3207/4885CDK8 924/4885CDK19 1433/4885

“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.