SCHEMBL176156

SCHEMBL176156

Cc1nc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)ccc1C(N)=O

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.66
HRH1 P35367 2/20 0.55

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
SCHEMBL3095037 0.82 HRH3 (0.60) HRH3HRH1
SCHEMBL3094829 0.81 HRH3 (0.60) HRH3HRH1
SCHEMBL3085980 0.81 HRH3 (0.64) HRH3HRH1
SCHEMBL3081307 0.80 HRH3 (0.58) HRH3HRH1
SCHEMBL3097058 0.80 NNMT (0.49) HRH3
SCHEMBL3087639 0.80 HRH3 (1.00) HRH3HRH1
SCHEMBL1707159 0.80 HRH3 (1.00) HRH3HRH1
SCHEMBL3087219 0.78 HRH3 (0.77) HRH3HRH1
SCHEMBL14563241 0.76 HRH3 (0.73) HRH3HRH1
SCHEMBL3082047 0.76 HRH3 (0.81) HRH3HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615090-A1 Nitrogen-containing fused heterocyclic compounds and their use as beta amyloid production inhibitors Eisai R&D Management Co., Ltd. (JP) 2013-07-17 EP disclosed
EP-2424528-A2 TREATMENT OF OSTEOARTHRITIS PAIN Abbott Laboratories (US) 2012-03-07 EP disclosed