SCHEMBL10429574

SCHEMBL10429574

c1ccc(CC2CCC3CCC2N3)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.43
POLB P06746 1/20 0.40
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39

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
SCHEMBL6944306 0.78 GBA1 (0.46) GBA1CHRNB4CHRNA3
SCHEMBL6944308 0.78 GBA1 (0.46) GBA1CHRNB4CHRNA3
SCHEMBL7678641 0.78 GBA1 (0.46) GBA1CHRNB4CHRNA3
SCHEMBL7680047 0.75 HTR3E (0.39) CHRNB4CHRNA3
SCHEMBL6941357 0.75 HTR3E (0.39) CHRNB4CHRNA3
SCHEMBL7243838 0.74 CHRNB2 (0.45) CHRNA3
SCHEMBL6941249 0.72 CHRNB4 (0.36) CHRNB4CHRNA3
SCHEMBL7235453 0.69 CHRNA7 (0.50) CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL5672686 0.69 CHRNB4 (0.42) GBA1CHRNB4CHRNA3
SCHEMBL4577960 0.69 GBA1 (0.55) GBA1

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
JP-2072178-A None JP disclosed
JP-H0272178-A CHEMICAL INTERMEDIATE BEECHAM GROUP PLC 1990-03-12 JP disclosed