SCHEMBL23975258

SCHEMBL23975258

CN(CCCNC(=O)C(C)(C)C)CCCNC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
CA14 Q9ULX7 1/20 0.38
TP53BP1 Q12888 4/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
TMEM97 Q5BJF2 3/20 0.35
SIGMAR1 Q99720 3/20 0.35
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DRD4 P21917 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
DRD2 P14416 1/20 0.33
DNM1 Q05193 1/20 0.33
EPHX1 P07099 1/20 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
SCHEMBL16316408 0.91 POLB (0.47) POLBCA14KDM4EMAPTTMEM97
SCHEMBL25942505 0.85 POLB (0.49) POLBCA14TP53BP1KDM4EMAPT
SCHEMBL23594056 0.85 POLB (0.49) POLBCA14TP53BP1KDM4EMAPT
SCHEMBL23975102 0.83 MEN1 (0.48) POLBCA14TP53BP1KDM4EMAPT
SCHEMBL14176540 0.81 CHRM2 (0.35) CA14
SCHEMBL23975224 0.80 POLB (0.40) POLBCA14KDM4EMAPTTMEM97
SCHEMBL10201764 0.80 DNM1 (0.49) POLBCA14KDM4EMAPTALDH1A1
SCHEMBL12438387 0.79 EPHX1 (0.47) POLBDNM1EPHX1
SCHEMBL16316406 0.79 POLB (0.42) POLBCA14KDM4EMAPTALDH1A1
SCHEMBL25826388 0.77 POLB (0.42) POLBCA14TP53BP1KDM4EMAPT

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-20210338825-A1 DEGRADERS OF HEPATITIS C VIRUS NS3/4A PROTEIN DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-11-04 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-20210338825-A1 DEGRADERS OF HEPATITIS C VIRUS NS3/4A PROTEIN HAVCR2, CUL4A, PSMC3 POLB 2662/4885CA14 4153/4885TP53BP1 334/4885

“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.