SCHEMBL10649783

SCHEMBL10649783

CNC(=O)OC1=C(C)NC(C)=C(OC(=O)OC)C1c1ccccc1OCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.41
TACR1 P25103 3/20 0.38
FFAR1 O14842 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
CARM1 Q86X55 2/20 0.37
PRMT1 Q99873 2/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
NR1I2 O75469 1/20 0.36
HTR1A P08908 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 1/20 0.35
PTPRC P08575 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
SCHEMBL9690877 0.91 HTR6 (0.43) HTR6TACR1FFAR1KDM4EGAA
SCHEMBL10646848 0.90 HTR6 (0.43) HTR6TACR1FFAR1KDM4EGAA
SCHEMBL10647317 0.88 POLB (0.42) KDM4EGAANR1I2HTR1ASLC6A2
SCHEMBL10646450 0.86 FABP4 (0.42) FFAR1KDM4EGAAMAPTNR1I2
SCHEMBL10815688 0.85 HTR6 (0.47) HTR6TACR1FFAR1KDM4ECARM1
SCHEMBL10647313 0.84 KDM4E (0.41) KDM4EGAAMAPTNR1I2TSHR
SCHEMBL10914095 0.81 POLB (0.46) KDM4EGAAMAPTNR1I2HTR1A
SCHEMBL10644589 0.81 KMT2A (0.45) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL10649425 0.81 POLB (0.40) KDM4EGAANR1I2MEN1KMT2A
SCHEMBL9691722 0.80 KDM4E (0.43) KDM4EGAAMAPTNR1I2HTR1A

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
EP-0288758-A2 Dihydropyridinamides, process for their preparation and their use in medicines BAYER AG (DE) 1988-11-02 EP disclosed