SCHEMBL5000770

SCHEMBL5000770

COc1ccc(N2CCN(c3cncc(-c4csc5ccccc45)n3)CC2)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.41
MAPT P10636 6/20 0.41
TP53 P04637 2/20 0.41
IMPDH2 P12268 2/20 0.40
HTR7 P34969 2/20 0.40
ACVRL1 P37023 1/20 0.39
ACVR1 Q04771 1/20 0.39
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
NTSR1 P30989 1/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PTGER2 P43116 2/20 0.38
PGK1 P00558 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL4994805 0.87 MAPT (0.53) MAPTTP53KDM4EALDH1A1L3MBTL1
SCHEMBL4997051 0.87 MAPT (0.55) MAPTTP53ACVRL1ACVR1KDM4E
SCHEMBL4996259 0.85 HTR7 (0.44) MAPTHTR7KDM4EALDH1A1HPGD
SCHEMBL4987386 0.85 MAPT (0.57) MAPTTP53KDM4EALDH1A1L3MBTL1
SCHEMBL4995160 0.85 ACVRL1 (0.41) MAPTTP53ACVRL1ACVR1KDM4E
SCHEMBL4997730 0.83 ACVRL1 (0.43) MAPTTP53ACVRL1ACVR1KDM4E
SCHEMBL4995180 0.83 MAPT (0.44) SSTR5MAPTTP53ACVRL1ACVR1
SCHEMBL4997044 0.82 HTR7 (0.46) SSTR5MAPTHTR7ACVR1KDM4E
SCHEMBL4997527 0.81 MAPT (0.48) MAPTTP53HTR7ACVRL1ACVR1
SCHEMBL4994812 0.81 RAB9A (0.48) MAPTTP53ACVRL1ACVR1KDM4E

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-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases AXXIMA PHARMACEUTICALS AG (DE) 2008-08-14 US claimed

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-20080194574-A1 Pyrazine Derivatives As Effective Compounds Against Infectious Diseases PRNP, PSEN1, PPP5C SSTR5 200/4885MAPT 5/4885TP53 551/4885

“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.