SCHEMBL1773015

SCHEMBL1773015

O=C(O)c1nc(CC2CCN(c3ccccc3)CC2)nc(O)c1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.39
ME3 Q16798 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
GRM5 P41594 1/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
GRIN2B Q13224 1/20 0.38
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
LRRK2 Q5S007 1/20 0.37
LTB4R Q15722 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.37
CHRM4 P08173 1/20 0.37

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
SCHEMBL1773048 0.91 HRH3 (0.41) ME3SLC6A2SLC6A4HRH3GRIN2B
SCHEMBL1773145 0.89 MAPT (0.39) F10SLC6A2SLC6A4GRM5TSHR
SCHEMBL1772304 0.88 GPR119 (0.41) F10MAPTLMNACHRM4
Hydrochloric Acid SCHEMBL1773577 0.85 ME3 (0.42) ME3ALDH1A1GRIN2BMAPTLRRK2
SCHEMBL1772452 0.84 POLB (0.40) MAPT
SCHEMBL12002658 0.83 SLC6A2 (0.44) F10SLC6A2SLC6A4ALDH1A1MAPT
SCHEMBL1773245 0.83 YAP1 (0.47) GRIN2BMAPTLMNA
SCHEMBL12602285 0.82 HRH3 (0.40) F10ME3SLC6A2SLC6A4HRH3
SCHEMBL1772065 0.82 HRH3 (0.38) ME3SLC6A2SLC6A4HRH3GRIN2B
SCHEMBL1772041 0.81 HRH3 (0.41) SLC6A2SLC6A4ALDH1A1HRH3GRIN2B

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-20110112103-A1 5-HYDROXYPYRIMIDINE-4-CARBOXAMIDE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-05-12 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-20110112103-A1 5-HYDROXYPYRIMIDINE-4-CARBOXAMIDE COMPOUND EPOR, CBR1, CBR3 F10 534/4885ME3 1908/4885SLC6A2 4391/4885

“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.