SCHEMBL11067692

SCHEMBL11067692

C=CCCCCCCCCC=CCCCN(C(=O)OCc1ccccc1)c1ccccc1C(=O)Cl

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
TGM2 P21980 2/20 0.35
CCR6 P51684 1/20 0.35
PAX8 Q06710 1/20 0.35
LMNA P02545 2/20 0.34
HCAR2 Q8TDS4 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
POLB P06746 1/20 0.32
F13A1 P00488 1/20 0.32
TGM1 P22735 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 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
SCHEMBL11490974 0.84 ALDH1A1 (0.40) ALDH1A1TGM2CCR6PAX8LMNA
SCHEMBL11070809 0.81 PTPN1 (0.35) ALDH1A1TGM2CCR6PAX8HCAR2
SCHEMBL11492891 0.73 ALDH1A1 (0.43) ALDH1A1PAX8MAPTHPGD
SCHEMBL4651960 0.72 ALDH1A1 (0.49) ALDH1A1CCR6PAX8LMNAHCAR2
SCHEMBL15001656 0.71 CCR6 (0.56) ALDH1A1TGM2CCR6PAX8LMNA
SCHEMBL27353515 0.71 TGM2 (0.51) ALDH1A1TGM2CCR6PAX8LMNA
SCHEMBL504963 0.70 CCR6 (0.52) ALDH1A1TGM2CCR6PAX8LMNA
SCHEMBL10240182 0.68 CCR6 (0.55) ALDH1A1TGM2CCR6PAX8LMNA
SCHEMBL11070648 0.68 FAAH (0.41) ALDH1A1PAX8TRPV1KDM4EMAPT
SCHEMBL11070645 0.68 FAAH (0.41) ALDH1A1PAX8TRPV1KDM4EMAPT

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
US-4440940-A HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-04-03 US disclosed