SCHEMBL8520184

SCHEMBL8520184

CCCCCOc1ccsc1-c1sccc1OCCCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA2A P08913 1/20 0.40
OPRK1 P41145 1/20 0.40
HTR2B P41595 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
NR5A1 Q13285 1/20 0.40
LTA4H P09960 2/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL5133914 0.98 NR5A1 (0.43) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL1279017 0.98 NR5A1 (0.43) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL3103832 0.98 NR5A1 (0.43) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL19351456 0.87 MEN1 (0.40) MAPTMEN1NR1I2LMNACHRM2
SCHEMBL12377798 0.85 RARB (0.41) CYP1A2CYP2C9CYP2C19MEN1LMNA
SCHEMBL5831689 0.85 MEN1 (0.43) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL15401900 0.84 MCHR1 (0.40) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL19351841 0.84 MCHR1 (0.40) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL19861980 0.81 PTPN11 (0.40) MAPTCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL1872168 0.81 MCHR1 (0.38) MAPTMEN1NR1I2LMNACHRM2

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-0945723-A1 Process for preparing electro-conductive polymer films by doping neutral polymers De Rossi, Danilo (IT) 1999-09-29 EP disclosed