SCHEMBL12424848

SCHEMBL12424848

CCCCC(CC)Cc1ccc(C2=C3C(=O)NC(c4ccc(CC(CC)CCCC)cc4)=C3C(=O)N2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 3/20 0.40
ALDH1A1 P00352 5/20 0.33
CYP3A4 P08684 3/20 0.33
MME P08473 1/20 0.33
ACE P12821 1/20 0.33
CPA1 P15085 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
CA2 P00918 1/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
HTT P42858 2/20 0.33
TSHR P16473 2/20 0.33
GLA P06280 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
PDE2A O00408 2/20 0.32
PDE9A O76083 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.31

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
SCHEMBL12424847 0.95 MME (0.40) BDKRB2ALDH1A1CYP3A4MMEACE
SCHEMBL16492016 0.80 CYP3A4 (0.39) ALDH1A1CYP3A4CA2L3MBTL1TSHR
SCHEMBL153634 0.78 BDKRB2 (0.48) BDKRB2ALDH1A1CYP3A4CA2L3MBTL1
SCHEMBL18092320 0.74 BDKRB2 (0.51) BDKRB2ALDH1A1CYP3A4MMEACE
SCHEMBL3419642 0.74 BDKRB2 (0.42) BDKRB2ALDH1A1CYP3A4CA2L3MBTL1
SCHEMBL22914733 0.74 PLA2G2A (0.39) ALDH1A1CYP3A4CA2L3MBTL1TSHR
SCHEMBL15045082 0.74 RARB (0.53) ALDH1A1CYP3A4TSHRMEN1KMT2A
SCHEMBL12424737 0.73 EGFR (0.48) ALDH1A1CA2
SCHEMBL13179926 0.73 GPR84 (0.39) ALDH1A1CA2TSHRMAPT
SCHEMBL25028100 0.72 HSD11B1 (0.50) ALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed