SCHEMBL25905013

SCHEMBL25905013

N#Cc1ccc(N[C@H]2CC[C@H](N)CC2)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
CDK2 P24941 2/20 0.47
MAPKAPK2 P49137 2/20 0.47
IDO1 P14902 1/20 0.47
DPP4 P27487 3/20 0.44
SLC22A12 Q96S37 3/20 0.41
PGR P06401 2/20 0.41
TRPV4 Q9HBA0 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
KCNH2 Q12809 1/20 0.38
AR P10275 3/20 0.38

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
SCHEMBL3125940 0.82 HDAC8 (0.48) HDAC8HDAC6CDK2MAPKAPK2IDO1
SCHEMBL9984392 0.82 HDAC8 (0.48) HDAC8HDAC6IDO1DPP4SLC22A12
Hydrochloric Acid SCHEMBL382423 0.81 HDAC8 (0.47) HDAC8HDAC6IDO1DPP4SLC22A12
SCHEMBL24299484 0.81 HDAC8 (0.53) HDAC8HDAC6IDO1DPP4SLC22A12
SCHEMBL27169503 0.81 HDAC8 (0.53) HDAC8HDAC6IDO1DPP4SLC22A12
SCHEMBL29666012 0.79 TRPA1 (0.53) SLC22A12AR
SCHEMBL5031297 0.77 DPP4 (0.47) HDAC8HDAC6IDO1DPP4SLC22A12
SCHEMBL3022620 0.77 DPP4 (0.47) HDAC8HDAC6IDO1DPP4SLC22A12
SCHEMBL25039462 0.76 CHEK1 (0.38) CDK2MAPKAPK2DPP4SLC22A12IRAK4
SCHEMBL30279151 0.76 CHEK1 (0.38) CDK2MAPKAPK2DPP4SLC22A12IRAK4

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-20230233690-A1 ANDROGEN RECEPTOR PROTEIN DEGRADERS UNIV MICHIGAN REGENTS (US) 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-20230233690-A1 ANDROGEN RECEPTOR PROTEIN DEGRADERS AR, SHBG, CYP19A1 HDAC8 2474/4885HDAC6 2553/4885CDK2 361/4885

“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.