SCHEMBL6199849

SCHEMBL6199849

C#CC(O/N=C1/c2cc(OC)c(OC)cc2-c2[nH]c3ccc(OCCN4CCCC4)cc3c21)c1ccoc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
TOP1 P11387 5/20 0.42
PARP1 P09874 2/20 0.36
LTA4H P09960 1/20 0.34
ACHE P22303 2/20 0.34
KMT2A Q03164 1/20 0.34
FLT3 P36888 5/20 0.34
ESR1 P03372 1/20 0.33

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
SCHEMBL6199856 1.00 TLR8 (0.42) TLR8TLR7TOP1PARP1LTA4H
Hydrochloric Acid SCHEMBL7247183 0.99 TLR8 (0.42) TLR8TLR7TOP1PARP1LTA4H
Hydrochloric Acid SCHEMBL7247181 0.99 TLR8 (0.42) TLR8TLR7TOP1PARP1LTA4H
SCHEMBL6200041 0.87 TOP1 (0.39) TLR8TLR7TOP1PARP1FLT3
SCHEMBL6200047 0.87 TOP1 (0.39) TLR8TLR7TOP1PARP1FLT3
Hydrochloric Acid SCHEMBL7235176 0.86 TOP1 (0.39) TOP1PARP1FLT3
Hydrochloric Acid SCHEMBL7235171 0.86 TOP1 (0.39) TOP1PARP1FLT3
Hydrochloric Acid SCHEMBL7246736 0.85 POLB (0.35) TOP1PARP1KMT2AESR1
Hydrochloric Acid SCHEMBL7246732 0.85 POLB (0.35) TOP1PARP1KMT2AESR1
Hydrochloric Acid SCHEMBL7226286 0.80 TOP1 (0.34) TOP1PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1266887-B1 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2005-08-17 EP claimed
US-6627650-B2 An isomer thereof, or an addition salt thereof with a pharmaceutically acceptable acid or base. Medicinal products containing the same which are useful as anti- cancer agents. LES LABORATOIRES SERVIER (FR) 2003-09-30 US claimed
US-20030125369-A1 Indeno(1,2-b)indole oximes or indeno(1,2-b) indole hydrazones used as anticancer agent LES LABORATOIRES SERVIER (FR) 2003-07-03 US claimed
US-6627650-B2 An isomer thereof, or an addition salt thereof with a pharmaceutically acceptable acid or base. Medicinal products containing the same which are useful as anti- cancer agents. LES LABORATOIRES SERVIER (FR) 2003-09-30 US disclosed
US-20030125369-A1 Indeno(1,2-b)indole oximes or indeno(1,2-b) indole hydrazones used as anticancer agent LES LABORATOIRES SERVIER (FR) 2003-07-03 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-20030125369-A1 Indeno(1,2-b)indole oximes or indeno(1,2-b) indole hydrazones used as anticancer agent IDO1, IDO2, AHR TLR8 1794/4885TLR7 1808/4885TOP1 104/4885

“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.