SCHEMBL9869376

SCHEMBL9869376

CCN1CCC(c2nc3ccccc3[nH]2)C1

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 3/20 0.60
POLB P06746 3/20 0.56
PKM P14618 1/20 0.51
MPO P05164 1/20 0.51
MAPT P10636 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CHRNA7 P36544 1/20 0.50
KDM4E B2RXH2 2/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL14218700 0.93 HTR2B (0.65) HTR2BPOLBPKMMAPTHSD17B10
SCHEMBL14218701 0.92 POLB (0.62) HTR2BPOLBPKMKDM4E
SCHEMBL666433 0.89 PARP1 (0.60) HTR2BPOLBPKMMPOMAPT
SCHEMBL9870915 0.87 HTR2B (0.56) HTR2BPOLBPKMMPOMAPT
SCHEMBL664921 0.85 HTR2B (0.57) HTR2BPOLBPKMCHRNA7KDM4E
SCHEMBL9869744 0.83 PKM (0.56) HTR2BPOLBPKMKDM4EKMT2A
SCHEMBL30365989 0.83 PKM (0.56) HTR2BPOLBPKMKDM4EKMT2A
SCHEMBL738976 0.82 POLB (0.63) HTR2BPOLBPKMKDM4E
SCHEMBL662101 0.82 PARP1 (0.64) HTR2BCHRNA7
SCHEMBL6883705 0.80 PKM (0.62) HTR2BPKMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5063228-A 4-(substitutedaminoethyl)-3,4-dihydro-2-alkylpyrimido[1,6-a]benzimidazol-1(2H)-ones as antiarrhythmic agents A. H. ROBBINS COMPANY, INCORPORATED (US) 1991-11-05 US disclosed