SCHEMBL28035651

SCHEMBL28035651

Cn1cc(C(C)(C)P)cn1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
IRAK1 P51617 1/20 0.31
PDK2 Q15119 1/20 0.30
BRD4 O60885 1/20 0.30

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
SCHEMBL179481 0.83 KDM5B (0.33) ALDH1A1HTTSMN1; SMN2L3MBTL1BRD4
SCHEMBL23154609 0.79 ALDH1A1 (0.34) ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL19815546 0.79 PIK3CD (0.33) ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL26858663 0.79 KCNH2 (0.35) ALDH1A1HTTSMN1; SMN2L3MBTL1IRAK1
SCHEMBL19135627 0.79 ALDH1A1 (0.31) ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL2611113 0.78 NPBWR1 (0.41) ALDH1A1HTTSMN1; SMN2L3MBTL1PDK2
SCHEMBL19176085 0.76 JAK2 (0.35) ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL21536772 0.76 ALOX5AP (0.33)
SCHEMBL21863672 0.76 ALDH1A1 (0.33) ALDH1A1HTTSMN1; SMN2L3MBTL1
SCHEMBL24861815 0.76 JAK2 (0.33) ALDH1A1HTTSMN1; SMN2L3MBTL1

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
CN-105331591-A PQQ-sGDH mutant, polynucleotide and glucose detection device GENCLONN BIOTECH HANGZHOU CO LTD 2016-02-17 CN disclosed