SCHEMBL6736067

SCHEMBL6736067

C/C(=N\O)c1ccc(OCCCc2nc[nH]c2C)cc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.46
FURIN P09958 1/20 0.42
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL6681517 1.00 HRH3 (0.46) HRH3FURINHRH2HRH1HRH4
SCHEMBL29440065 0.80 HRH3 (0.73) HRH3
SCHEMBL6658784 0.78 HRH3 (0.56) HRH3HRH2HRH1HRH4TDP1
SCHEMBL647792 0.75 FURIN (0.43) HRH3FURIN
SCHEMBL647793 0.75 FURIN (0.43) HRH3FURIN
SCHEMBL12014234 0.71 NR1I2 (0.58) FURIN
SCHEMBL27937157 0.70 FURIN (0.50) FURIN
SCHEMBL6660013 0.68 NPC1 (0.47) HRH3HRH2HRH1HRH4TDP1
SCHEMBL8739981 0.68 GAA (0.75) HRH3FURIN
SCHEMBL10101376 0.68 GAA (0.75) HRH3FURIN

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-20040127718-A1 Substituted imidazoles NOVO NORDISK A/S (DK) 2004-07-01 US disclosed
US-20030181479-A1 Substituted imidazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2003-09-25 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 (2 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-20030181479-A1 Substituted imidazoles HRH3, HRH4, HRH2 HRH3 1/4885FURIN 4816/4885HRH2 3/4885
US-20040127718-A1 Substituted imidazoles HRH3, HRH4, HRH2 HRH3 1/4885FURIN 4816/4885HRH2 3/4885

“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.