SCHEMBL7472253

SCHEMBL7472253

CCOCCn1c(C(=O)C2CCN(CCC(CN(C)C(=O)c3cc(C4C=NN=N4)ccc3OC)c3ccc(Cl)c(Cl)c3)CC2)nc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.50
TACR2 P21452 16/20 0.45

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
SCHEMBL7467147 0.94 HRH1 (0.44) HRH1TACR2
SCHEMBL7470419 0.93 HRH1 (0.48) HRH1TACR2
SCHEMBL7472406 0.92 HRH1 (0.45) HRH1TACR2
SCHEMBL7467466 0.92 HRH1 (0.45) HRH1TACR2
SCHEMBL7464003 0.91 TACR2 (0.44) HRH1TACR2
SCHEMBL7478141 0.91 TACR2 (0.44) HRH1TACR2
SCHEMBL7472937 0.91 TACR2 (0.43) HRH1TACR2
SCHEMBL7473690 0.91 TACR2 (0.44) HRH1TACR2
SCHEMBL7473695 0.91 TACR2 (0.44) HRH1TACR2
SCHEMBL7473614 0.91 TACR2 (0.44) HRH1TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882038-B1 SUBSTITUTED N-METHYL-N-(4-(PIPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES AVENTIS PHARMA INC (US) 2002-12-18 EP disclosed
US-6297259-B1 HISTAMINE RECEPTOR ANTAGONISTS AND TACHYKININ RECEPTOR ANTAGONISTS. AVENTIS PHARMACEUTICALS INC. 2001-10-02 US disclosed
EP-0882038-A1 NOVEL SUBSTITUTED N-METHYL-N-(4-(PIPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1998-12-09 EP disclosed
WO-1997030990-A1 NOVEL SUBSTITUTED N-METHYL-N-(4-(PIPERIDIN-1-YL)-2-(ARYL)BUTYL)BENZAMIDES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-08-28 WO disclosed