SCHEMBL1279017

SCHEMBL1279017

CCCCCCCCCCCCCCOc1ccsc1-c1sccc1OCCCCCCCCCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
MCHR1 Q99705 2/20 0.40
TLR8 Q9NR97 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CHUK O15111 1/20 0.39
DAPK3 O43293 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 1.00 NR5A1 (0.43) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL3103832 1.00 NR5A1 (0.43) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL8520184 0.98 MAPT (0.40) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL19351456 0.89 MEN1 (0.40) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL5831689 0.87 MEN1 (0.43) MAPTMEN1NR1I2LMNACHRM2
SCHEMBL15401900 0.85 MCHR1 (0.40) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL19351841 0.85 MCHR1 (0.40) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL12377798 0.84 RARB (0.41) MEN1LMNACYP3A4KMT2ACYP1A2
SCHEMBL9641044 0.83 NR5A1 (0.42) NR5A1MAPTMEN1NR1I2LMNA
SCHEMBL17135289 0.83 NR5A1 (0.42) NR5A1MAPTMEN1NR1I2LMNA

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
US-8993711-B2 Semiconducting polymers and optoelectronic devices incorporating same POLYERA CORPORATION (US) 2015-03-31 US disclosed
US-20120085993-A1 SEMICONDUCTING POLYMERS AND OPTOELECTRONIC DEVICES INCORPORATING SAME USINVEST LLC 2012-04-12 US disclosed