SCHEMBL28034928

SCHEMBL28034928

OC(C1CCCC1)N1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.39
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
GMNN O75496 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
EPHX1 P07099 1/20 0.34
HTT P42858 2/20 0.34
TSHR P16473 2/20 0.34
HIF1A Q16665 1/20 0.32

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
SCHEMBL20633452 0.92 FDPS (0.36) FDPSTP53SMN1; SMN2KDM4EGMNN
SCHEMBL17733703 0.82 SIGMAR1 (0.41) TP53SMN1; SMN2KDM4EGMNNLMNA
SCHEMBL17827126 0.82 DPP4 (0.33) FDPSTP53
SCHEMBL14103774 0.82 SMN1; SMN2 (0.33) FDPSSMN1; SMN2EPHX1
SCHEMBL22628621 0.79 CPN1 (0.33) KDM4ELMNATSHR
SCHEMBL19631132 0.79 KDM4E (0.42) TP53SMN1; SMN2KDM4ELMNAMAPT
SCHEMBL23716166 0.75 HRH3 (0.38) KDM4EMAPT
SCHEMBL15451117 0.73
SCHEMBL14655522 0.72 EPHX1 (0.52) FDPSEPHX1HTTTSHR
SCHEMBL19513190 0.70 HSD11B1 (0.44) TP53SMN1; SMN2KDM4EGMNNLMNA

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-103025725-B Heterocyclic compounds ASTELLAS PHARMA INC. (JP) 2015-09-16 CN disclosed