SCHEMBL19110593

SCHEMBL19110593

Cc1nn(Cc2ccc(Cl)cc2F)c2c1CCNC2

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.39
PDE5A O76074 2/20 0.39
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
RIPK3 Q9Y572 3/20 0.39
PTGDR2 Q9Y5Y4 3/20 0.38
MCHR1 Q99705 3/20 0.38
GRM2 Q14416 1/20 0.38
HTR1A P08908 1/20 0.38
HTR2A P28223 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
SCHEMBL19110605 0.88 LMNA (0.45) HTR7HTR1AHTR2A
SCHEMBL17317909 0.84 NR1H2 (0.44) HTR7NR1H2NR1H3RIPK3MCHR1
Hydrochloric Acid SCHEMBL17317524 0.84 NR1H2 (0.44) HTR7NR1H2NR1H3RIPK3GRM2
SCHEMBL19110602 0.83 CYP1A2 (0.40) HTR7PDE5AHTR1AHTR2A
SCHEMBL19110587 0.82 HTR7 (0.53) HTR7HTR1AHTR2A
SCHEMBL19110655 0.79 HTR7 (0.43) HTR7HTR1AHTR2A
SCHEMBL19110586 0.78 SLC2A1 (0.48) HTR7
SCHEMBL17317631 0.77 PNMT (0.40) HTR7NR1H2NR1H3RIPK3GRM2
Hydrochloric Acid SCHEMBL17317645 0.76 PNMT (0.40) HTR7NR1H2NR1H3RIPK3MCHR1
SCHEMBL19110591 0.75 HTR7 (0.54) HTR7HTR1AHTR2A

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-20170197960-A1 ATX MODULATING AGENTS BIOGEN MA INC. 2017-07-13 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-20170197960-A1 ATX MODULATING AGENTS ENPP2, ATXN10, ATXN2 HTR7 755/4885PDE5A 411/4885NR1H2 1523/4885

“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.