SCHEMBL13800751

SCHEMBL13800751

COc1cc(-c2cncc(CN3CCC(N(Cc4cccc(-c5cc(OC)c(OC)c(OC)c5)c4)c4ccc(F)cc4)CC3)c2)cc(OC)c1OC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.44
DRD3 P35462 9/20 0.41
DRD4 P21917 8/20 0.41
DRD2 P14416 7/20 0.41
TGFBR1 P36897 1/20 0.41
ACVR1 Q04771 1/20 0.41
HCRTR1 O43613 2/20 0.39
HCRTR2 O43614 2/20 0.39
BCHE P06276 2/20 0.39
BACE1 P56817 2/20 0.39
ACHE P22303 1/20 0.39
QPCT Q16769 1/20 0.38
HTR1A P08908 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2B P41595 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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 SCHEMBL7218584 0.99 HTR7 (0.43) HTR7DRD3DRD4DRD2TGFBR1
SCHEMBL13800744 0.95 DRD3 (0.44) HTR7DRD3DRD4DRD2TGFBR1
Hydrochloric Acid SCHEMBL7225224 0.94 DRD3 (0.43) HTR7DRD3DRD4DRD2TGFBR1
SCHEMBL13800604 0.92 TGFBR1 (0.43) HTR7DRD4TGFBR1ACVR1HCRTR1
SCHEMBL13800341 0.92 HTR7 (0.43) HTR7DRD3DRD4DRD2TGFBR1
SCHEMBL13800778 0.92 HTR7 (0.46) HTR7DRD4TGFBR1ACVR1HCRTR1
SCHEMBL13800750 0.92 HTR7 (0.52) HTR7DRD3DRD4DRD2BCHE
SCHEMBL13800723 0.92 HTR7 (0.41) HTR7DRD3DRD4DRD2TGFBR1
SCHEMBL13800622 0.92 CYP3A4 (0.46) HTR7TGFBR1ACVR1BCHEBACE1
Hydrochloric Acid SCHEMBL7217819 0.92 TGFBR1 (0.42) HTR7DRD4TGFBR1ACVR1HCRTR1

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 3747/4885DRD3 1731/4885DRD4 1352/4885

“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.