SCHEMBL8570586

SCHEMBL8570586

CCC(Cl)CCC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
MAPT P10636 3/20 0.50
LMNA P02545 2/20 0.50
NR4A2 P43354 1/20 0.50
KMT2A Q03164 4/20 0.49
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPK1 P28482 3/20 0.47
GSK3B P49841 2/20 0.47
TRPA1 O75762 1/20 0.47
HIF1A Q16665 1/20 0.47
HDAC1 Q13547 2/20 0.46
GAA P10253 1/20 0.46
CYP2C19 P33261 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46

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
SCHEMBL11004445 0.84 ALDH1A1 (0.53) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL5195513 0.81 TSHR (0.55) L3MBTL1TDP1MAPTLMNAKMT2A
SCHEMBL1395104 0.81 L3MBTL1 (0.53) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL9720590 0.81 TDP1 (0.57) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL11104045 0.80 L3MBTL1 (0.52) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL1283829 0.80 L3MBTL1 (0.52) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL15661338 0.80 L3MBTL1 (0.52) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL7649584 0.79 TDP1 (0.55) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL4745748 0.79 L3MBTL1 (0.50) L3MBTL1TDP1MAPTLMNANR4A2
SCHEMBL810448 0.79 MAOA (0.39) MAPTLMNASMN1; SMN2CES1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998005961-A1 COMPOUNDS HAVING A PLURALITY OF NITROGENOUS SUBSTITUENTS ISIS PHARMACEUTICALS, INC. (US) 1998-02-12 WO disclosed
EP-0035228-B1 TETRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND ANTI-ULCER COMPOSITION CONTAINING THE SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-01-02 EP disclosed
US-4372953-A Tetrazole derivatives, and anti-ulcer composition containing the same OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1983-02-08 US disclosed