SCHEMBL16484487

SCHEMBL16484487

Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc4c5c(cccc35)-c3c-4c(-c4ccccc4)c4ccccc4c3-c3ccccc3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.38
ACHE P22303 1/20 0.34
CRHR1 P34998 2/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
LMNA P02545 1/20 0.33
CA9 Q16790 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
COMT P21964 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
GPR84 Q9NQS5 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.31
CKS1B P61024 1/20 0.31
SKP2 Q13309 1/20 0.31
MAPT P10636 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL4078983 0.93 ENPP1 (0.35) ENPP1ACHEALDH1A1KDM4EMAPT
SCHEMBL12032229 0.93 ENPP1 (0.35) ENPP1ACHEALDH1A1KDM4EMAPT
SCHEMBL23764463 0.93 ENPP1 (0.33) ENPP1ACHECRHR1GPR84KDM4E
SCHEMBL23764153 0.92 KDM4E (0.32) ENPP1ACHECRHR1ALDH1A1KDM4E
SCHEMBL23764421 0.92 KDM4E (0.32) ENPP1ACHECRHR1ALDH1A1KDM4E
SCHEMBL12032283 0.92 ENPP1 (0.35) ENPP1ACHEALDH1A1KDM4EMAPT
SCHEMBL23764074 0.91 HTT (0.33) ENPP1CRHR1LMNAALDH1A1KDM4E
SCHEMBL12032255 0.89 ALDH1A1 (0.35) ENPP1ACHEALDH1A1KDM4EMAPT
SCHEMBL23764347 0.88 DHODH (0.33) ENPP1ACHECRHR1HPRT1
SCHEMBL23764083 0.87 PDK2 (0.33) ENPP1CRHR1SMN1; SMN2ALDH1A1MAPT

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-2014057874-A1 FLUORANTHENE DERIVATIVE, LUMINESCENT ELEMENT MATERIAL CONTAINING SAME, AND LUMINESCENT ELEMENT 東レ株式会社 (JP) 2014-04-17 WO disclosed