SCHEMBL9370820

SCHEMBL9370820

C[N+]1(C)CCCCC1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 14/20 0.47
CHRM4 P08173 14/20 0.47
CHRM5 P08912 14/20 0.47
CHRM1 P11229 14/20 0.47
CHRM3 P20309 14/20 0.47
ALOX15 P16050 1/20 0.40

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
SCHEMBL7054926 0.79 ALOX15 (0.37) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8497209 0.74 ALDH1A1 (0.36) ALOX15
SCHEMBL7830511 0.73 SLC18A3 (0.35) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL16887928 0.73 ALOX15 (0.74) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL14245531 0.73 ALOX15 (0.74) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL29883811 0.73 ALOX15 (0.74) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL15313621 0.72 CHRM2 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL16226181 0.72 TSHR (0.37)
SCHEMBL14415874 0.69 CHRM2 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL23456768 0.68 CHRNB2 (0.43)

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-0600952-A1 AZACYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. MERCK SHARP & DOHME (GB) 1994-06-15 EP claimed
WO-1993004040-A1 AZACYCLIC COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM MERCK SHARP & DOHME LIMITED (GB) 1993-03-04 WO claimed