SCHEMBL2809384

SCHEMBL2809384

Clc1nc(N2CCCC2)nc2c1cnn2CCN1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 19/20 0.54

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
SCHEMBL2809937 0.85 HRH1 (0.44) SIGMAR1
SCHEMBL2787920 0.77 HRH1 (0.63)
SCHEMBL14636547 0.77 SIGMAR1 (0.71) SIGMAR1
SCHEMBL14635580 0.77 SIGMAR1 (0.71) SIGMAR1
SCHEMBL175230 0.73 ADORA2A (0.47) SIGMAR1
SCHEMBL3992479 0.73 SIGMAR1 (0.56) SIGMAR1
SCHEMBL11980070 0.71 PIK3CA (0.50) SIGMAR1
SCHEMBL14636070 0.70 SIGMAR1 (1.00) SIGMAR1
SCHEMBL14922347 0.69 ADORA2A (0.55)
SCHEMBL15703420 0.68 SIGMAR1 (1.00) SIGMAR1

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
WO-2010118367-A2 ANTIVIRAL PYRIMIDINES PROGENICS PHARMACEUTICALS, INC. (US) 2010-10-14 WO disclosed