SCHEMBL8691850

SCHEMBL8691850

Cc1cc(NCCCN2CCCCC2)nc2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.65
HRH2 P25021 1/20 0.58
HRH1 P35367 1/20 0.58
ACP1 P24666 9/20 0.58
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56

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
SCHEMBL8691834 0.90 HRH3 (0.58) HRH3MEN1KMT2A
SCHEMBL8694610 0.88 KDM4E (0.67) HRH3ACP1MEN1KMT2A
SCHEMBL8692776 0.87 SLC2A1 (0.56) HRH3MEN1KMT2A
SCHEMBL8692258 0.85 KDM4E (0.62) HRH3ACP1MEN1KMT2A
SCHEMBL7207251 0.84 KDM4E (0.51) HRH3HRH1KMT2A
Bromide SCHEMBL7207307 0.83 DRD2 (0.50) HRH3HRH1KMT2A
Bromide SCHEMBL7209939 0.82 KDM4E (0.51) HRH1
SCHEMBL8691758 0.81 CHRM1 (0.63) ACP1MEN1KMT2A
SCHEMBL491641 0.81 ACP1 (0.70) HRH3ACP1
Bromide SCHEMBL7210682 0.80 DRD2 (0.54) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5770734-A N-substituted-2-aminoquinolines useful for treating hypofunction of the cholinergic system AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-23 US claimed
US-5770734-A N-substituted-2-aminoquinolines useful for treating hypofunction of the cholinergic system AMERICAN HOME PRODUCTS CORPORATION (US) 1998-06-23 US disclosed
US-5149815-A Anticholirergic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1992-09-22 US disclosed
US-5093333-A N-substituted-2-aminoquinolines useful for treating hypofunction of the cholinergic system AMERICAN HOME PRODUCTS CORPORATION (US) 1992-03-03 US disclosed