SCHEMBL28852248

SCHEMBL28852248

O=C(CCSc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1)OC(=O)CCSc1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.39
PKM P14618 1/20 0.39
MAPK1 P28482 2/20 0.35
POLB P06746 4/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
APP P05067 1/20 0.34
HPGD P15428 3/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 3/20 0.33
HSP90AA1 P07900 1/20 0.33
KCNH2 Q12809 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ATM Q13315 1/20 0.32
NPC1 O15118 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL353399 0.86 ALDH1A1 (0.40) HTTMAPK1POLBL3MBTL1HPGD
SCHEMBL1356152 0.85 PKM (0.40) HTTPKML3MBTL1HPGDLMNA
SCHEMBL17145189 0.85 HPGD (0.36) HTTPKMHPGDLMNAHSP90AA1
SCHEMBL13648613 0.85 HTT (0.34) HTTPKMMAPK1POLBL3MBTL1
SCHEMBL29281059 0.82 ALDH1A1 (0.51) KMT2AMEN1NPC1CYP1A2CYP2D6
SCHEMBL17145191 0.80 RXFP1 (0.42) HTTMAPK1L3MBTL1HPGDNPC1
SCHEMBL4284556 0.78 FFAR1 (0.46) POLBHPGDLMNAMAPTKMT2A
SCHEMBL13648646 0.78 ALDH1A1 (0.35) HTTMAPK1POLBL3MBTL1HPGD
SCHEMBL13578479 0.77 CA12 (0.38) HTTPKMMAPK1POLBL3MBTL1
SCHEMBL353401 0.77 L3MBTL1 (0.49) MAPK1POLBL3MBTL1HPGDLMNA

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-115128904-A Photosensitive composition and film formed therefrom 财团法人工业技术研究院 2022-09-30 CN disclosed