SCHEMBL7408771

SCHEMBL7408771

Cn1c2ccc(F)cc2c2c(C(=O)O)cn(-c3ccccc3)c(=O)c21

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.52
LMNA P02545 4/20 0.52
ALDH1A1 P00352 7/20 0.48
HPGD P15428 5/20 0.48
HSD17B10 Q99714 4/20 0.48
GAA P10253 1/20 0.48
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SRC P12931 1/20 0.42
RORC P51449 1/20 0.42
TP53 P04637 2/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40

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
SCHEMBL7412441 0.89 SRC (0.44) KDM4ELMNAALDH1A1MEN1KMT2A
SCHEMBL7413021 0.89 KDM4E (0.45) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL7411367 0.86 KDM4E (0.44) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL7407974 0.86 KDM4E (0.41) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL4954775 0.86 HPGD (0.53) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL7411565 0.85 KDM4E (0.48) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL30417631 0.76 KDM4E (0.53) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL7415364 0.74 KDM4E (0.46) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL7412091 0.74 GAA (0.49) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL7411167 0.73 PTGDR2 (0.46) KDM4EALDH1A1HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934319-B1 1H-PYRIDO[3,4-b]INDOLE-4-CARBOXAMIDE DERIVATIVES, PREPARATION AND APPLICATION THEREOF IN THERAPEUTICS SANOFI SYNTHELABO (FR) 2002-06-05 EP disclosed
US-6075021-A 1H-pyrido[3,4-b]indole-4-carboxamide derivatives, preparation and application thereof in therapeutics SYNTHELABO (FR) 2000-06-13 US disclosed