SCHEMBL6500241

SCHEMBL6500241

N=C(N)N/N=C1\CC(c2ccccc2)Cc2[nH]c3ccc(Cl)cc3c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 5/20 0.47
CLK4 Q9HAZ1 5/20 0.47
MAP2 P11137 4/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
AXL P30530 1/20 0.39
PTK2B Q14289 1/20 0.39
MAPKAPK5 Q8IW41 1/20 0.39
SRPK1 Q96SB4 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
ROCK2 O75116 2/20 0.39
CSF1R P07333 2/20 0.39
MAPK1 P28482 2/20 0.39
GSK3A P49840 2/20 0.39
GSK3B P49841 2/20 0.39
LIMK1 P53667 2/20 0.39
STK3 Q13188 2/20 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
SCHEMBL6500243 1.00 PIM1 (0.47) PIM1CLK4MAP2KDM4EALDH1A1
SCHEMBL6487430 0.88 MAPT (0.40) PIM1CLK4KDM4EALDH1A1MAPT
SCHEMBL6492165 0.88 ALDH1A1 (0.42) PIM1CLK4KDM4EALDH1A1MAPT
SCHEMBL6487428 0.88 MAPT (0.40) PIM1CLK4KDM4EALDH1A1MAPT
SCHEMBL6492163 0.88 ALDH1A1 (0.42) PIM1CLK4KDM4EALDH1A1MAPT
SCHEMBL7128314 0.86 MAPT (0.35) PIM1CLK4KDM4EALDH1A1MAPT
SCHEMBL6495347 0.86 MAPT (0.35) PIM1CLK4KDM4EALDH1A1MAPT
SCHEMBL6488194 0.78 MAP3K14 (0.46) MAP2KDM4EALDH1A1MAPTGAA
SCHEMBL6488195 0.78 MAP3K14 (0.46) MAP2KDM4EALDH1A1MAPTGAA
SCHEMBL6487432 0.75 SIRT1 (0.37) MAP2KDM4EALDH1A1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951881-B2 (1-substituted-indol-3-yl) alkylidenehydrazinecarboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2005-10-04 US disclosed
US-20030232843-A1 (1-Substituted-indol-3-yl) alkylidenehydrazinecarboximidamide derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2003-12-18 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-20030232843-A1 (1-Substituted-indol-3-yl) alkylidenehydrazinecarboximidamide derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR1A PIM1 3896/4885CLK4 4482/4885MAP2 1097/4885

“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.