SCHEMBL20497372

SCHEMBL20497372

Fc1ccc(OCC2CCCCC2COc2ccc(F)cc2Br)c(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.50
RAB9A P51151 4/20 0.43
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42
HTR2B P41595 2/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.40
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 3/20 0.36
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL20497371 1.00 PKM (0.50) PKMRAB9AHTR2AHTR2CHTR2B
SCHEMBL21949867 0.86 PKM (0.49) PKMRAB9AHTR2AHTR2CHTR2B
SCHEMBL985592 0.83 HTR2A (0.54) PKMRAB9AHTR2AHTR2CHTR2B
SCHEMBL18586429 0.80 LMNA (0.51) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL18615875 0.80 LMNA (0.51) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL21949703 0.80 LMNA (0.51) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL29642919 0.80 LMNA (0.51) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL20448925 0.80 LMNA (0.51) RAB9ANPC1SMN1; SMN2MAPTKDM4E
SCHEMBL9774749 0.77 ALDH1A1 (0.50) PKMRAB9AHTR2AHTR2CHTR2B
SCHEMBL31710999 0.77 HTR2A (0.48) PKMRAB9AHTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10870713-B2 Procatalyst and polymerization process using the same DOW GLOBAL TECHNOLOGIES LLC (US) 2020-12-22 US disclosed
EP-3356431-B1 PROCATALYST AND POLYMERIZATION PROCESS USING THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2020-04-22 EP disclosed
US-20180265604-A1 PROCATALYST AND POLYMERIZATION PROCESS USING THE SAME DOW GLOBAL TECHNOLOGIES LLC (US) 2018-09-20 US disclosed