SCHEMBL19632152

SCHEMBL19632152

CC(=O)C1CCN(C(=O)N2CCN(C)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HTT P42858 1/20 0.46
LMNA P02545 1/20 0.44
HRH3 Q9Y5N1 3/20 0.41
NPSR1 Q6W5P4 1/20 0.40
CYP2D6 P10635 1/20 0.39
KCNH2 Q12809 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD11B1 P28845 1/20 0.38
PPP5C P53041 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PPP2CA P67775 1/20 0.38
TFPI2 P48307 1/20 0.38
NPY4R P50391 1/20 0.38
CHRM3 P20309 1/20 0.37

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
SCHEMBL890089 0.83 CYP1A2 (0.44) CYP1A2TDP1HTTLMNAHRH3
SCHEMBL25511901 0.82 ALDH1A1 (0.47) HTTHRH3ALDH1A1
SCHEMBL25498169 0.80 HTT (0.70) CYP1A2TDP1HTTLMNAALDH1A1
SCHEMBL25498347 0.80 HTT (0.70) CYP1A2TDP1HTTLMNAALDH1A1
SCHEMBL25499141 0.80 HTT (0.55) CYP1A2TDP1HTTLMNAALDH1A1
SCHEMBL5470776 0.80 CYP1A2 (0.65) CYP1A2TDP1HTTLMNANPSR1
SCHEMBL18390873 0.79 CYP1A2 (0.48) CYP1A2TDP1HTTLMNAHRH3
SCHEMBL18390876 0.79 CYP1A2 (0.48) CYP1A2TDP1HTTLMNAHRH3
SCHEMBL13779985 0.79 ALDH1A1 (0.48) CYP1A2TDP1HTTLMNAHRH3
SCHEMBL12639932 0.78 MEN1 (0.53) LMNA

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-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-11-23 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-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L CYP1A2 4008/4885TDP1 290/4885HTT 1940/4885

“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.