SCHEMBL6100561

SCHEMBL6100561

CNc1ccc2c(c1)/C(=C1\OCc3cc(OCCN4CCOCC4)ccc31)C(=O)N2

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 12/20 0.53
FLT3 P36888 1/20 0.47
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47
NCSTN Q92542 1/20 0.47
APH1A Q96BI3 1/20 0.47
PSENEN Q9NZ42 1/20 0.47
LRRK2 Q5S007 1/20 0.47
PAK1 Q13153 1/20 0.42
NPC1 O15118 1/20 0.41
CCR4 P51679 1/20 0.41
CHEK1 O14757 1/20 0.41

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
SCHEMBL6100565 1.00 MAPK14 (0.53) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6088078 0.89 LRRK2 (0.60) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6086388 0.89 MAPK14 (0.49) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6086383 0.89 MAPK14 (0.49) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6088086 0.89 LRRK2 (0.60) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6086663 0.87 MAPK14 (0.55) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6086658 0.87 MAPK14 (0.55) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6102940 0.87 MAPK14 (0.47) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6102944 0.87 MAPK14 (0.47) MAPK14FLT3PSEN1PSEN2APH1B
SCHEMBL6086556 0.85 MAPK14 (0.46) MAPK14FLT3PSEN1PSEN2APH1B

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-20060004084-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2006-01-05 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-20060004084-A1 (3Z)-3-(2,3-dihydro-1H-inden-1-ylidene)-1,3-dihydro-2H-indol-2-ones as kinase inhibitors CDK2, ERBB2, MAP3K3 MAPK14 186/4885FLT3 298/4885PSEN1 3304/4885

“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.