SCHEMBL4193608

SCHEMBL4193608

O=C(C1CC1)N(Cc1ccccc1)C1[C@@H]2CC[C@H]1CNC2

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
CTSD P07339 1/20 0.51
OPRM1 P35372 4/20 0.50
CCR5 P51681 6/20 0.44
KCNH2 Q12809 2/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.41
CPB1 P15086 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRM5 P08912 1/20 0.39

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
SCHEMBL13853362 1.00 MEN1 (0.52) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL4201992 0.80 CCR5 (0.53) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL13853361 0.80 OPRM1 (0.60) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL13853364 0.80 CCR5 (0.53) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL4201650 0.80 OPRM1 (0.60) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL13853360 0.80 OPRM1 (0.53) MEN1KMT2AOPRM1CCR5HTT
SCHEMBL4197879 0.80 OPRM1 (0.53) MEN1KMT2AOPRM1CCR5HTT
SCHEMBL4132155 0.78 SLC6A2 (0.60) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL4198203 0.77 OPRM1 (0.62) MEN1KMT2ACTSDOPRM1CCR5
SCHEMBL2421731 0.76 CTSD (0.56) MEN1KMT2ACTSDOPRM1

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-20090124635-A1 CHEMICAL COMPOUNDS PFIZER INC. (GB) 2009-05-14 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-20090124635-A1 CHEMICAL COMPOUNDS CCR5, CXCR3, CCR2 MEN1 3241/4885KMT2A 3004/4885CTSD 3509/4885

“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.