SCHEMBL9489609

SCHEMBL9489609

Brc1[nH]nc(C2CN3CCC2C3)c1I

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.36
CHRM1 P11229 1/20 0.36

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
Fumaric Acid SCHEMBL9564592 0.89 CHRM2 (0.30) CHRM2CHRM1
SCHEMBL9564571 0.76 CHRNA7 (0.39)
SCHEMBL9486003 0.72 CHRM2 (0.38) CHRM2
SCHEMBL2123369 0.66 CHRNA7 (0.41)
SCHEMBL2122732 0.64 CHRM2 (0.39) CHRM2CHRM1
SCHEMBL9459025 0.62 CHRM2 (0.51) CHRM2CHRM1
SCHEMBL9584136 0.61 CHRM2 (0.40) CHRM2CHRM1
SCHEMBL9458728 0.60
SCHEMBL8187794 0.60 CHRM2 (0.46) CHRM2CHRM1
SCHEMBL7818040 0.60 CHRM2 (0.46) CHRM2CHRM1

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-5227394-A PYRAZOLE DERIVATIVES, COMPOSITIONS AND USE AKZO N.V. (NL) 1993-07-13 US disclosed