SCHEMBL6203624

SCHEMBL6203624

COc1cc2c(cc1OC)-c1[nH]c3ccc(OCCN4CCCC4)cc3c1C2=O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.53
TLR7 Q9NYK1 1/20 0.53
PARP1 P09874 2/20 0.51
ACHE P22303 4/20 0.49
ESR1 P03372 2/20 0.49
DRD2 P14416 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
TOP1 P11387 1/20 0.46
MAOB P27338 1/20 0.45
FLT3 P36888 1/20 0.45

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
Hydrochloric Acid SCHEMBL7226820 0.99 TLR8 (0.52) TLR8TLR7PARP1ACHEESR1
SCHEMBL6203630 0.99 PARP1 (0.52) TLR8TLR7PARP1ACHEESR1
Hydrochloric Acid SCHEMBL7227956 0.98 PARP1 (0.52) TLR8TLR7PARP1ACHEESR1
SCHEMBL7234037 0.82 TLR8 (0.48) TLR8TLR7PARP1ACHEDRD2
SCHEMBL7234034 0.82 TLR8 (0.48) TLR8TLR7PARP1ACHEDRD2
SCHEMBL6203062 0.81 PARP1 (0.46) PARP1ESR1DRD2HRH3TOP1
Hydrochloric Acid SCHEMBL7235812 0.81 PARP1 (0.45) PARP1ESR1DRD2HRH3TOP1
SCHEMBL6203750 0.80 ALDH1A1 (0.50)
Hydrochloric Acid SCHEMBL7234662 0.79 ABCG2 (0.49)
SCHEMBL6202045 0.78 ESR1 (0.55) ACHEESR1HRH3MAOB

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 4 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 disclosed
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
EP-1266887-A2 Indenoindoline derivatives, their process of preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2002-12-18 EP 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 1808/4885PARP1 265/4885

“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.