SCHEMBL7954906

SCHEMBL7954906

CCOCCn1c(C(=O)C2CCNCC2)nc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 12/20 0.52
KDM4E B2RXH2 1/20 0.49
KCNH2 Q12809 2/20 0.48
ALDH1A1 P00352 1/20 0.48
CHRM1 P11229 1/20 0.47

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
SCHEMBL7478188 0.87 HRH1 (0.42) HRH1KDM4EALDH1A1
SCHEMBL7473747 0.87 HRH1 (0.41) HRH1KDM4EALDH1A1
SCHEMBL7471446 0.87 HRH1 (0.42) HRH1KDM4EALDH1A1
SCHEMBL7466438 0.83 HRH1 (0.54) HRH1KDM4EALDH1A1
SCHEMBL9695580 0.82 POLB (0.60) HRH1KDM4EALDH1A1
SCHEMBL9267715 0.82 HRH1 (0.53) HRH1KDM4EKCNH2CHRM1
SCHEMBL9260913 0.81 HRH1 (0.51) HRH1KDM4EKCNH2CHRM1
Bromide SCHEMBL3553550 0.81 POLB (0.59) HRH1KDM4EALDH1A1
SCHEMBL9260555 0.81 HRH1 (0.65) HRH1
SCHEMBL9260920 0.80 KDM4E (0.50) KDM4EALDH1A1

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 7 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
US-5380731-A Antiallergic compounds MERRELL DOW PHARMACEUTICALS INC. (US) 1995-01-10 US disclosed
EP-0561973-A1 ANTIALLERGIC COMPOUNDS MERRELL DOW PHARMACEUTICALS INC. (US) 1993-09-29 EP disclosed
WO-1992010491-A1 ANTIALLERGIC COMPOUNDS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-06-25 WO disclosed