SCHEMBL7529690

SCHEMBL7529690

Cc1cc(Cl)ccc1N[C]=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 1/20 0.49
MAPK1 P28482 1/20 0.46
GAA P10253 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
POLB P06746 1/20 0.44
ALDH1A1 P00352 3/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MAPT P10636 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
EGFR P00533 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TP53 P04637 1/20 0.40
LMNA P02545 1/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 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
SCHEMBL1758539 0.84 RAPGEF4 (0.50) GAAPOLBALDH1A1MAPTLMNA
SCHEMBL2089857 0.79 HPGD (0.46) MAPK1GAASMN1; SMN2RAB9ANPC1
SCHEMBL1356507 0.79 MEN1 (0.50) MAPK1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL3132939 0.76 KMT2A (0.47) SMN1; SMN2RAB9ANPC1POLBALDH1A1
SCHEMBL7523466 0.76 SIGMAR1 (0.44) GAARAB9ANPC1POLBALDH1A1
SCHEMBL7479613 0.76 MAPK1 (0.46) NOX1MAPK1GAASMN1; SMN2RAB9A
SCHEMBL7530691 0.76 LPAR1 (0.49) GAANPC1ALDH1A1HPGDMEN1
SCHEMBL1758628 0.75 MEN1 (0.50) POLBALDH1A1HPGDMEN1KMT2A
SCHEMBL9233011 0.74 NOX1 (0.55) NOX1MAPK1GAASMN1; SMN2RAB9A
SCHEMBL28748358 0.74 NOX1 (0.55) NOX1MAPK1GAASMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP disclosed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US disclosed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO disclosed
US-4140860-A BACTERICIDES STERLING DRUG INC. (US) 1979-02-20 US disclosed
US-4119668-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1978-10-10 US disclosed
US-4085144-A ANTIBACTERIAL STERLING DRUG INC. (US) 1978-04-18 US disclosed
US-4022833-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1977-05-10 US disclosed