SCHEMBL6367185

SCHEMBL6367185

Cn1c2c(c3ccccc31)CCN(CCCCc1n[nH]c(=O)c3ccccc13)C2

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.58
HTR5A P47898 8/20 0.54
HTR7 P34969 1/20 0.50

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
Bromide SCHEMBL28066351 0.76 HTR5A (0.68) HTR5AHTR7
SCHEMBL6367272 0.73 PARP1 (1.00) PARP1
SCHEMBL22944855 0.73 HTR5A (0.67) HTR5A
SCHEMBL29133429 0.72 HTR5A (0.52) PARP1HTR5AHTR7
SCHEMBL6367194 0.72 PARP1 (0.98) PARP1
SCHEMBL30704377 0.71 HTR5A (0.56) HTR5AHTR7
SCHEMBL29133431 0.71 HTR5A (0.56) HTR5AHTR7
SCHEMBL6368050 0.70 PARP1 (0.85) PARP1HTR7
SCHEMBL6366828 0.70 PARP1 (0.70) PARP1HTR7
SCHEMBL6373163 0.70 PARP1 (0.70) PARP1HTR7

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-20050080096-A1 Condensed heterocyclic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-14 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-20050080096-A1 Condensed heterocyclic compounds PARP1, PARP2, PARP3 PARP1 1/4885HTR5A 1443/4885HTR7 1505/4885

“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.