SCHEMBL4487432

SCHEMBL4487432

COC1CCN(C(=O)c2ccc3cc(OC4CCN(CC(C)C)CC4)ccc3c2)CC1

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.85
LMNA P02545 1/20 0.56
KMT2A Q03164 5/20 0.51
MEN1 O00255 3/20 0.51
CYP2D6 P10635 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL4490575 0.92 HRH3 (1.00) HRH3KMT2AMEN1
SCHEMBL4496386 0.92 HRH3 (0.84) HRH3KMT2AMEN1
SCHEMBL4498703 0.91 HRH3 (0.83) HRH3KMT2AMEN1
SCHEMBL4500028 0.89 HRH3 (0.80) HRH3KMT2AMEN1
SCHEMBL4496409 0.89 HRH3 (0.80) HRH3KMT2AMEN1
SCHEMBL4506659 0.89 HRH3 (0.80) HRH3KMT2AMEN1CYP2D6MAPK1
SCHEMBL4509013 0.86 HRH3 (1.00) HRH3
SCHEMBL4495576 0.82 HRH3 (0.70) HRH3KMT2AMEN1
SCHEMBL4510317 0.82 HRH3 (0.88) HRH3KMT2A
SCHEMBL3387972 0.82 HRH3 (0.76) HRH3KMT2AMEN1

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 1/4885LMNA 1696/4885KMT2A 588/4885
US-20060009449-A1 Naphthaline derivatives as H3 inverse agonists HRH3, HRH4, HRH1 HRH3 1/4885LMNA 1696/4885KMT2A 588/4885

“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.