Sugi Predict

Sugi Predict / Compounds / SCHEMBL7954792

SCHEMBL7954792

SCHEMBL7954792

CCc1c(OC)c(OC)cc(C(=O)N2CCC(CCN3CCC(C(=O)c4nc5ccccc5n4Cc4ccccn4)CC3)(c3ccccc3)C2)c1OC(C)=O

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 20/20 0.78

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
SCHEMBL7956232 0.96 HRH1 (0.76) HRH1
SCHEMBL7954898 0.94 HRH1 (0.79) HRH1
SCHEMBL7956138 0.91 HRH1 (0.69) HRH1
SCHEMBL7961326 0.90 HRH1 (0.91) HRH1
SCHEMBL7954826 0.90 HRH1 (0.79) HRH1
SCHEMBL7947663 0.90 HRH1 (0.77) HRH1
SCHEMBL7954552 0.89 HRH1 (0.78) HRH1
SCHEMBL7961135 0.89 HRH1 (0.93) HRH1
SCHEMBL7947303 0.88 HRH1 (1.00) HRH1
SCHEMBL7960995 0.86 HRH1 (0.77) HRH1

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
US-6329392-B1 ANTIALLERGENS AVENTIS PHARMACEUTICALS, INC. 2001-12-11 — — US disclosed
EP-0777666-B1 SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMA INC (US) 1999-03-03 — — EP disclosed
EP-0777666-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1997-06-11 — — EP disclosed
WO-1996006094-A1 NOVEL SUBSTITUTED PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES MERRELL PHARMACEUTICALS INC. (US) 1996-02-29 — — WO disclosed