SCHEMBL13800682

SCHEMBL13800682

COc1cc(-c2cccc(CN3CCC(N(Cc4cccc(-c5cc(OC)c(OC)c(OC)c5)c4)c4ccc(Cl)cc4)CC3)c2)cc(OC)c1OC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.49
MCL1 Q07820 1/20 0.49
BCHE P06276 5/20 0.45
BACE1 P56817 5/20 0.45
ACHE P22303 4/20 0.45
USP2 O75604 1/20 0.44
LMNA P02545 1/20 0.44
THRB P10828 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
DRD4 P21917 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CHRM2 P08172 2/20 0.41
CHRM3 P20309 2/20 0.41
PDE4B Q07343 1/20 0.40
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 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
Hydrochloric Acid SCHEMBL7217857 0.99 HTR7 (0.48) HTR7MCL1BCHEBACE1ACHE
SCHEMBL13800674 0.92 MCL1 (0.43) HTR7MCL1BCHEBACE1ACHE
SCHEMBL13800673 0.92 MCL1 (0.43) HTR7MCL1BCHEBACE1ACHE
SCHEMBL13800660 0.92 MCL1 (0.43) HTR7MCL1BCHEBACE1ACHE
Hydrochloric Acid SCHEMBL7224133 0.91 MCL1 (0.42) HTR7MCL1BCHEBACE1ACHE
SCHEMBL13800606 0.91 HTR7 (0.50) HTR7MCL1BCHEBACE1ACHE
SCHEMBL13800345 0.91 HTR7 (0.50) HTR7MCL1BCHEBACE1ACHE
Hydrochloric Acid SCHEMBL7219934 0.91 MCL1 (0.42) HTR7MCL1BCHEBACE1ACHE
Hydrochloric Acid SCHEMBL7218015 0.91 MCL1 (0.42) HTR7MCL1BCHEBACE1ACHE
Hydrochloric Acid SCHEMBL7218320 0.90 HTR7 (0.49) HTR7BCHEBACE1ACHELMNA

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-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 US disclosed
US-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR KOWA CO., LTD. (JP) 2009-06-04 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-20090143430-A1 ERYTHROPOIETIN PRODUCTION ACCELERATOR EPOR, GHRHR, ARL1 HTR7 3747/4885MCL1 786/4885BCHE 4545/4885

“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.