SCHEMBL4886717

SCHEMBL4886717

CCc1nc(CCN2C(=O)c3ccccc3C2=O)n(CC)c1Sc1cc(Cl)cc(C#N)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PDE10A Q9Y233 3/20 0.35
ADRA1D P25100 2/20 0.34
ADRA1A P35348 2/20 0.34
ADRA1B P35368 2/20 0.34
PKM P14618 1/20 0.34
KDR P35968 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PGK1 P00558 1/20 0.33
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL4884582 0.92 TSHR (0.36) L3MBTL1ADRA1DADRA1AADRA1BKDR
SCHEMBL4905138 0.85 TSHR (0.39) LMNAL3MBTL1ADRA1DADRA1AADRA1B
SCHEMBL4882617 0.81 KCNH2 (0.34)
SCHEMBL14108423 0.81 KCNH2 (0.34)
SCHEMBL4879837 0.79 KCNH2 (0.37) SMN1; SMN2POLB
SCHEMBL4887120 0.79 KCNH2 (0.35) SMN1; SMN2POLB
Cadaverine Tartrate SCHEMBL4875994 0.76
SCHEMBL4884600 0.75 KDM4E (0.34) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL4875978 0.75 KCNH2 (0.33) ADRA1DALDH1A1SMN1; SMN2POLBKDM4E
SCHEMBL4896799 0.74 KCNH2 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators PFIZER INC 2008-07-24 US disclosed
US-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators PFIZER INC 2008-07-24 US disclosed
US-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators PFIZER INC 2008-07-24 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-20080176919-A1 Imidazole Derivatives As Enzyme Reverse Transcriptase Modulators POLRMT, POLR1G, POLR2A LMNA 2163/4885RXFP1 2732/4885L3MBTL1 1256/4885

“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.