SCHEMBL29502802

SCHEMBL29502802

O=C1c2ccccc2C(=O)c2cc(Nc3c(Cl)cccc3Cl)ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGA1 P56199 1/20 0.49
RAB9A P51151 6/20 0.49
NPC1 O15118 6/20 0.49
MAPT P10636 6/20 0.49
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
MAOA P21397 1/20 0.49
S100A4 P26447 1/20 0.49
PTPRC P08575 2/20 0.47
THRB P10828 1/20 0.47
PKM P14618 1/20 0.47
ACE2 Q9BYF1 1/20 0.46
PTPN22 Q9Y2R2 1/20 0.46
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
POLB P06746 2/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL8394314 1.00 ITGA1 (0.49) ITGA1RAB9ANPC1MAPTALDH1A1
SCHEMBL7929799 0.83 MEN1 (0.46) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL25835031 0.79 MAPK14 (0.55) ITGA1RAB9ANPC1MAPTALDH1A1
SCHEMBL25252212 0.78 MAPK14 (0.58) ITGA1RAB9ANPC1MAPTALDH1A1
SCHEMBL25834567 0.78 MAPK14 (0.58) ITGA1RAB9ANPC1MAPTALDH1A1
SCHEMBL9543511 0.77 APP (0.59) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL21817075 0.75 SMN1; SMN2 (0.47) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL14675727 0.75 APP (0.57) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL7928255 0.75 MAPT (0.41) RAB9ANPC1MAPTALDH1A1SMN1; SMN2
SCHEMBL22625591 0.72 NPC1 (0.56) ITGA1RAB9ANPC1MAPTALDH1A1

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
CN-113661065-B Resin composition, molded body, optical layer, cover member, and moving body 住友电木株式会社 2022-05-10 CN disclosed