SCHEMBL5557951

SCHEMBL5557951

Fc1ccc(C[CH]c2ccncc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
TRPA1 O75762 1/20 0.39
RAB9A P51151 2/20 0.38
USP2 O75604 1/20 0.38
LTA4H P09960 1/20 0.38
CYP11B1 P15538 3/20 0.38
CYP19A1 P11511 2/20 0.38
CYP11B2 P19099 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GRK2 P25098 1/20 0.37
IDO1 P14902 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37

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
SCHEMBL27575289 0.92 ALDH1A1 (0.40) L3MBTL1SMN1; SMN2ALDH1A1HTTGSK3A
SCHEMBL8202649 0.85 CYP3A4 (0.48) SMN1; SMN2ALDH1A1RAB9ACYP11B1CYP19A1
SCHEMBL8364378 0.85 TRPA1 (0.45) TRPA1RAB9AKMT2AIDO1LOXL2
SCHEMBL8210813 0.79 NFE2L2 (0.52) L3MBTL1SMN1; SMN2ALDH1A1TRPA1MEN1
SCHEMBL6456118 0.79 G6PC1 (0.49) SMN1; SMN2ALDH1A1HTTCYP19A1CYP11B2
SCHEMBL16178490 0.76 MAPT (0.49) SMN1; SMN2ALDH1A1HTTTRPA1RAB9A
SCHEMBL3274573 0.76 NFE2L2 (0.57) SMN1; SMN2ALDH1A1HTTTRPA1RAB9A
SCHEMBL5966235 0.75 CYP1A2 (0.46) SMN1; SMN2ALDH1A1HTTCYP11B1CYP19A1
SCHEMBL654153 0.75 NFE2L2 (0.52) L3MBTL1SMN1; SMN2ALDH1A1TRPA1MEN1
SCHEMBL6632469 0.73 MAPT (0.62) L3MBTL1SMN1; SMN2ALDH1A1RAB9ACYP19A1

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
US-7169787-B2 7-azaindoles, use thereof as phosphodiesterase 4 inhibitors and method for producing the same ELBION AG (DE) 2007-01-30 US disclosed
CN-1247576-C Novel 7-azaindoles, their use as inhibitors of phosphodiesterase 4 and process for their preparation ELBION AG (DE) 2006-03-29 CN disclosed
CN-1484644-A Novel 7-azaindoles, their use as inhibitors of phosphodiesterase 4 and process for their preparation �����ɷ� 2004-03-24 CN disclosed