SCHEMBL4959925

SCHEMBL4959925

Cc1nnn(CC2CCN(C(=O)OCC(c3ccccc3Cl)n3ncnn3)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 19/20 0.43
USP2 O75604 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34

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
SCHEMBL4958443 0.89 POLB (0.39) USP2CHRM2CHRM5CHRM3
SCHEMBL4957412 0.82 FAAH (0.47)
SCHEMBL4311956 0.81 ENPP2 (0.43) ENPP2
SCHEMBL4958259 0.81 FAAH (0.41) CHRM2
SCHEMBL4958536 0.80 FAAH (0.41)
SCHEMBL4958808 0.80 SMN1; SMN2 (0.43)
SCHEMBL4958190 0.80 MGLL (0.42)
SCHEMBL4958786 0.79 POLB (0.37)
SCHEMBL4959460 0.79 MEN1 (0.41)
SCHEMBL4958347 0.79 CCR3 (0.42)

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-1879873-A1 NEUROTHERAPEUTIC AZOLE COMPOUNDS SK Holdings Co., Ltd. (KR) 2008-01-23 EP disclosed
WO-2006112685-A1 NEUROTHERAPEUTIC AZOLE COMPOUNDS SK HOLDINGS CO., LTD. (KR) 2006-10-26 WO disclosed