SCHEMBL4501323

SCHEMBL4501323

CC1CCCCN1C(=O)c1ccc2cc(OCCCN3CCCCC3)ccc2c1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 17/20 0.73
MAOB P27338 1/20 0.55
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.53
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL4503090 0.98 HRH3 (0.73) HRH3MAOBKDM4E
SCHEMBL4501931 0.89 HRH3 (0.59) HRH3
SCHEMBL2209023 0.85 HRH3 (0.75) HRH3MAOB
SCHEMBL4491953 0.85 HRH3 (0.66) HRH3MAOBKDM4E
SCHEMBL4502390 0.84 HRH3 (1.00) HRH3MAOBHPGD
SCHEMBL4503226 0.84 HRH3 (0.72) HRH3GAAHPGD
SCHEMBL2210611 0.83 HRH3 (0.75) HRH3MAOBKDM4E
SCHEMBL4512059 0.82 HRH3 (1.00) HRH3HPGDKDM4E
SCHEMBL4505393 0.82 HRH3 (1.00) HRH3HPGDKDM4E
SCHEMBL4503395 0.82 HRH3 (1.00) HRH3HPGDKDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608617-B2 Naphthaline derivatives as H3 inverse agonists HOFFMANN-LA ROCHE INC. (US) 2009-10-27 US disclosed
EP-1755593-B1 NAPHTHALENE DERIVATIVES USEFUL AS HISTAMINE-3-RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 2008-01-16 EP disclosed
US-20070265254-A1 Naphthaline derivatives as H3 inverse agonists MCARTHUR SILVIA G 2007-11-15 US disclosed
US-7259158-B2 Naphthaline derivatives as H3 inverse agonists HOFFMANN-LA ROCHE INC. (US) 2007-08-21 US disclosed
US-20060009449-A1 Naphthaline derivatives as H3 inverse agonists HOFFMAN-LA ROCHE INC. 2006-01-12 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 (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-20070265254-A1 Naphthaline derivatives as H3 inverse agonists HRH3, HRH4, HRH1 HRH3 1/4885MAOB 1735/4885GAA 2402/4885
US-20060009449-A1 Naphthaline derivatives as H3 inverse agonists HRH3, HRH4, HRH1 HRH3 1/4885MAOB 1735/4885GAA 2402/4885

“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.