SCHEMBL27523908

SCHEMBL27523908

CCCCCCCCOc1ccccc1N(C=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
NR1I2 O75469 1/20 0.46
LMNA P02545 1/20 0.46
CHRM2 P08172 1/20 0.46
CYP3A4 P08684 1/20 0.46
ADRA2A P08913 1/20 0.46
MAPT P10636 1/20 0.46
OPRK1 P41145 1/20 0.46
HTR2B P41595 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CYSLTR2 Q9NS75 2/20 0.41
CYSLTR1 Q9Y271 2/20 0.41
PPARG P37231 2/20 0.40
TLR8 Q9NR97 2/20 0.40
PLA2G4B P0C869 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL27910856 0.82 MEN1 (0.49) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL27490636 0.82 MEN1 (0.49) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL27913097 0.82 MEN1 (0.49) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL6934541 0.81 LMNA (0.49) MEN1NR1I2LMNACHRM2CYP3A4
Boric Acid SCHEMBL28174262 0.77 MEN1 (0.48) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL11447881 0.77 LMNA (0.44) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL10490480 0.76 MEN1 (0.51) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL28807470 0.76 CYP1A2 (0.53) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9879637 0.74 ALDH1A1 (0.43) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL2859001 0.73 LMNA (0.62) MEN1NR1I2LMNACHRM2CYP3A4

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-1046742-C Method for increasing molecular weight of polyester and premix used in method CIBA GEIGY AG (CH) 1999-11-24 CN disclosed
CN-1121350-A Increasing the molecular weight of polyesters and premix useful for this process CIBA GEIGY AG (CH) 1996-04-24 CN disclosed