SCHEMBL12379528

SCHEMBL12379528

Cc1ccc(N(C)c2cccc(CCCCCCCCc3ccc4c(c3)CC4)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.37
IGF1R P08069 1/20 0.36
ALOX15 P16050 1/20 0.36
FDPS P14324 1/20 0.34
GRIN2B Q13224 1/20 0.34
MLNR O43193 1/20 0.34
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
BCHE P06276 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
DRD2 P14416 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
SLC6A4 P31645 1/20 0.33
CHKA P35790 1/20 0.33

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
SCHEMBL12379497 0.96 SIGMAR1 (0.35) SIGMAR1IGF1RALOX15FDPSGRIN2B
SCHEMBL12379486 0.96 SIGMAR1 (0.35) SIGMAR1IGF1RALOX15FDPSGRIN2B
SCHEMBL12619714 0.96 SIGMAR1 (0.35) SIGMAR1IGF1RALOX15FDPSGRIN2B
SCHEMBL12619690 0.92 CHKA (0.35) SIGMAR1IGF1RALOX15FDPSGRIN2B
SCHEMBL12379527 0.91 SIGMAR1 (0.36) SIGMAR1GRIN2BBCHEDRD2SLC6A2
SCHEMBL12379488 0.90 SIGMAR1 (0.33) SIGMAR1IGF1RALOX15GRIN2BBCHE
SCHEMBL12379519 0.89 CHKA (0.37) SIGMAR1IGF1RALOX15FDPSGRIN2B
SCHEMBL16682921 0.88 IGF1R (0.37) SIGMAR1IGF1RALOX15GRIN2BMLNR
SCHEMBL16682920 0.88 IGF1R (0.37) SIGMAR1IGF1RALOX15GRIN2BMLNR
SCHEMBL12379499 0.87 IGF1R (0.41) SIGMAR1IGF1RALOX15GRIN2BMLNR

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-20110198573-A1 CHARGE-TRANSPORTING POLYMER, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-08-18 US disclosed