SCHEMBL2002148

SCHEMBL2002148

CCOc1ccc2c(c1)c(C(=O)c1noc(-c3ccncn3)n1)c(Cl)n2Cc1ccc(Cl)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 1/20 0.34
ALOX5AP P20292 3/20 0.34
POLB P06746 2/20 0.33
SLC26A4 O43511 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX5 P09917 1/20 0.32
EDNRB P24530 3/20 0.32
USP2 O75604 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
F10 P00742 1/20 0.31
NTRK1 P04629 1/20 0.31
PLA2G2A P14555 1/20 0.31
MAPK14 Q16539 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
SCHEMBL2002620 0.93 PLA2G2A (0.37) LMNAMAPTALOX5APCYP3A4CYP2C9
SCHEMBL2011061 0.92 ALOX5AP (0.39) LMNASMN1; SMN2MAPTALOX5APCYP3A4
SCHEMBL2008249 0.91 LMNA (0.34) LMNASMN1; SMN2MAPTCYP3A4CYP2C9
SCHEMBL2004879 0.91 ALOX5AP (0.33) LMNASMN1; SMN2MAPTALOX5APPOLB
SCHEMBL2006974 0.90 LMNA (0.38) LMNASMN1; SMN2MAPTALOX5APCYP2C9
SCHEMBL2005122 0.90 S1PR1 (0.38) LMNASMN1; SMN2MAPTALOX5APPOLB
SCHEMBL2001504 0.89 FAAH (0.35) LMNASMN1; SMN2MAPTCYP3A4CYP2C9
SCHEMBL2006939 0.88 L3MBTL1 (0.37) LMNASMN1; SMN2MAPTCYP3A4CYP2C9
SCHEMBL2003234 0.87 LMNA (0.35) LMNASMN1; SMN2MAPTALOX5APPOLB
SCHEMBL2008605 0.87 LMNA (0.41) LMNASMN1; SMN2MAPTPOLBCYP3A4

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-7960544-B2 Useful indole compounds IRONWOOD PHARMACEUTICALS, INC. (US) 2011-06-14 US disclosed