SCHEMBL28929233

SCHEMBL28929233

O=C1C=Cc2cccc3cc(-c4ccccc4)cc1c23

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 4/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
THRB P10828 2/20 0.42
IDO1 P14902 2/20 0.42
PTPRC P08575 2/20 0.42
BCHE P06276 2/20 0.42
PKM P14618 2/20 0.42
PTPN1 P18031 2/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ACHE P22303 1/20 0.42
RECQL P46063 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PTPN22 Q9Y2R2 1/20 0.42

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
SCHEMBL28928978 0.87 CES1 (0.42) CES1MEN1MAPTKMT2AALDH1A1
SCHEMBL30165991 0.83 NTRK1 (0.42) MEN1MAPTKMT2AALDH1A1PKM
SCHEMBL28928985 0.83 NTRK1 (0.42) MEN1MAPTKMT2AALDH1A1PKM
SCHEMBL30166000 0.81 PTPRC (0.46) MEN1MAPTKMT2AALDH1A1LMNA
SCHEMBL28962250 0.81 PTPRC (0.46) MEN1MAPTKMT2AALDH1A1LMNA
SCHEMBL5039128 0.79 ALDH1A1 (0.36) MEN1KMT2AALDH1A1PKMKDM4E
SCHEMBL30166002 0.79 NPC1 (0.46) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL28928989 0.79 NPC1 (0.46) MEN1MAPTKMT2AALDH1A1NPC1
SCHEMBL10015442 0.76 CES1 (0.57) CES1MEN1MAPTKMT2AALDH1A1
Perinaphthenone SCHEMBL29408331 0.75 ALDH1A1 (0.54) CES1MEN1MAPTKMT2AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115583876-B Phenyl naphthacene ketone compound and preparation method and application thereof 深圳技术大学 2023-12-19 CN disclosed
CN-115583876-A Phenyl-naphthalenepophenone compounds, preparation method and application thereof 深圳技术大学 2023-01-10 CN disclosed