SCHEMBL20253243

SCHEMBL20253243

c1cnc(-c2ccc(-c3ccc4cc(-c5ccc6ccccc6c5)c5cccnc5c4n3)cc2)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.41
CCR8 P51685 5/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
CLK2 P49760 1/20 0.39
HIPK1 Q86Z02 1/20 0.39
DYRK2 Q92630 1/20 0.39
HIPK2 Q9H2X6 1/20 0.39
HIPK3 Q9H422 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
CYP11B1 P15538 2/20 0.38
CYP17A1 P05093 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP11B2 P19099 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 2/20 0.38
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38

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
SCHEMBL20253247 0.99 CCR1 (0.40) CCR1CCR8L3MBTL1CLK2HIPK1
SCHEMBL20253240 0.90 TOP1 (0.47) CCR1CCR8L3MBTL1CYP11B1ALDH1A1
SCHEMBL20253250 0.89 CCR1 (0.40) CCR1CCR8L3MBTL1CLK2HIPK1
SCHEMBL20253180 0.89 CYP11B1 (0.43) CCR1CCR8L3MBTL1CYP11B1ALDH1A1
SCHEMBL20253249 0.89 TOP1 (0.46) CCR1CCR8L3MBTL1CYP11B1TOP1
SCHEMBL20253322 0.88 CYP11B1 (0.43) CCR1CCR8L3MBTL1CYP11B1ALDH1A1
SCHEMBL23921472 0.84 NPC1 (0.39) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL17125607 0.84 CCR1 (0.47) CCR1CCR8L3MBTL1CYP11B1ALDH1A1
SCHEMBL20253318 0.83 CCR1 (0.40) CCR1CCR8L3MBTL1ALDH1A1MAPT
SCHEMBL20253296 0.83 TOP1 (0.40) CCR1CCR8L3MBTL1ALDH1A1MAPT

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-2018105776-A1 PHENANTHROLINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING SAME 주식회사 진웅산업 2018-06-14 WO disclosed