SCHEMBL6776019

SCHEMBL6776019

CN1CCC=C(C2=NOC(CN3CCCC3=O)C2)C1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 6/20 0.64
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38

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
SCHEMBL6779518 0.78 CHRM1 (1.00) CHRM1
SCHEMBL6784178 0.70 CA12 (0.55) ADRA1DADRA1A
SCHEMBL6779493 0.69 ADRA1A (0.48) CHRM1ADRA1DADRA1A
SCHEMBL6778184 0.68 ADRA1D (0.37) ADRA1DADRA1A
SCHEMBL6777862 0.67 CHRM1 (0.43) CHRM1ADRA1DADRA1A
SCHEMBL6777739 0.66 ADRA1D (0.59) CHRM1ADRA1DADRA1A
SCHEMBL7087079 0.66 ADRA1D (0.45) CHRM1ADRA1DADRA1A
SCHEMBL7616080 0.63 CHRM4 (0.71) CHRM1ADRA1A
SCHEMBL22398815 0.63 TP53 (0.48) CHRM1
SCHEMBL1576503 0.63 TP53 (0.48) CHRM1

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
US-6759419-B2 NOOTROPIC AGENTS; BRAIN DISORDERS; ALZHEIMER'S DISEASE KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-07-06 US claimed
US-6759419-B2 NOOTROPIC AGENTS; BRAIN DISORDERS; ALZHEIMER'S DISEASE KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-07-06 US disclosed