SCHEMBL20253296

SCHEMBL20253296

c1ccc(-c2c3ccccc3c(-c3cc4ccc(-c5ccc(-c6ncccn6)cc5)nc4c4ncccc34)c3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 5/20 0.40
CCR1 P32246 2/20 0.37
CCR8 P51685 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
DHODH Q02127 4/20 0.34
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
PDE4A P27815 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
SCHEMBL20253321 0.99 TOP1 (0.39) TOP1CCR1CCR8L3MBTL1DHODH
SCHEMBL20253271 0.91 TOP1 (0.36) TOP1CCR1CCR8L3MBTL1MEN1
SCHEMBL20253240 0.90 TOP1 (0.47) TOP1CCR1CCR8L3MBTL1DHODH
SCHEMBL20253249 0.89 TOP1 (0.46) TOP1CCR1CCR8L3MBTL1DHODH
SCHEMBL20253315 0.88 TOP1 (0.37) TOP1CCR1CCR8L3MBTL1MEN1
SCHEMBL20253180 0.84 CYP11B1 (0.43) TOP1CCR1CCR8L3MBTL1MAPT
SCHEMBL20250552 0.83 PARP1 (0.38) TOP1L3MBTL1MEN1MAPTKMT2A
SCHEMBL17522017 0.83 CCR1 (0.48) TOP1CCR1CCR8L3MBTL1MAPT
SCHEMBL19762955 0.83 SMN1; SMN2 (0.40) TOP1CCR1CCR8MAPTALDH1A1
SCHEMBL20253243 0.83 CCR1 (0.41) TOP1CCR1CCR8L3MBTL1MAPT

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