SCHEMBL3434200

SCHEMBL3434200

NC(=O)c1ccc(N2CCc3nc(OCCCN4CCCC4)ccc3C2)nc1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 17/20 0.48
OPRD1 P41143 16/20 0.48
OPRK1 P41145 15/20 0.48
HRH3 Q9Y5N1 1/20 0.41
CHEK2 O96017 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
SCHEMBL3384977 0.99 OPRM1 (0.47) OPRM1OPRD1OPRK1HRH3CHEK2
SCHEMBL3389827 0.88 OPRM1 (0.39) OPRM1OPRD1OPRK1HRH3
SCHEMBL3387492 0.88 HRH3 (0.40) OPRM1OPRD1OPRK1HRH3
SCHEMBL3384476 0.85 HRH3 (0.41) OPRM1OPRD1OPRK1HRH3
SCHEMBL3385475 0.84 DRD2 (0.47) HRH3
SCHEMBL3389254 0.84 TMEM97 (0.43) HRH3
SCHEMBL3386233 0.84 DRD2 (0.43) HRH3
SCHEMBL13652075 0.82 HRH3 (0.39) HRH3
SCHEMBL3385297 0.81 HRH3 (0.40) OPRM1OPRD1OPRK1HRH3
SCHEMBL3388534 0.81 TIPARP (0.41) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090258861-A1 Tetrahydronaphthyridine Derivatives LUNN GRAHAM 2009-10-15 US claimed
US-7557121-B2 Tetrahydronaphthyridine derivatives PFIZER INC (US) 2009-07-07 US claimed
US-20050256135-A1 Tetrahydronaphthyridine derivatives LUNN GRAHAM 2005-11-17 US claimed
EP-1756104-B1 TETRAHYDRONAPHTHYRIDINE DERIVATIVES USEFUL AS HISTAMINE H3 RECEPTOR LIGANDS PFIZER LTD (GB) 2010-12-15 EP disclosed
US-20090258861-A1 Tetrahydronaphthyridine Derivatives LUNN GRAHAM 2009-10-15 US disclosed
US-20090258861-A1 Tetrahydronaphthyridine Derivatives LUNN GRAHAM 2009-10-15 US disclosed
US-20090258861-A1 Tetrahydronaphthyridine Derivatives LUNN GRAHAM 2009-10-15 US disclosed
US-7557121-B2 Tetrahydronaphthyridine derivatives PFIZER INC (US) 2009-07-07 US disclosed
US-20050256135-A1 Tetrahydronaphthyridine derivatives LUNN GRAHAM 2005-11-17 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-20050256135-A1 Tetrahydronaphthyridine derivatives HRH4, HRH3, HRH1 OPRM1 244/4885OPRD1 134/4885OPRK1 86/4885
US-20090258861-A1 Tetrahydronaphthyridine Derivatives HRH4, HRH3, HRH1 OPRM1 244/4885OPRD1 134/4885OPRK1 86/4885

“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.