SCHEMBL13869834

SCHEMBL13869834

CCN(CC)c1ccc2c(C)c(-c3cccc(-c4cnc(-c5ccc(-c6cc7cc8ccccc8cc7oc6=O)cc5)cn4)c3)c(=O)oc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.52
ALDH1A1 P00352 9/20 0.52
KDM4E B2RXH2 8/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
HPGD P15428 3/20 0.52
HIF1A Q16665 1/20 0.52
EP300 Q09472 1/20 0.48
HTT P42858 8/20 0.45
KMT2A Q03164 7/20 0.45
MEN1 O00255 6/20 0.45
LMNA P02545 5/20 0.45
NPC1 O15118 5/20 0.45
RAB9A P51151 4/20 0.45
USP2 O75604 3/20 0.45
NR1H4 Q96RI1 1/20 0.44
ATM Q13315 6/20 0.43
GLA P06280 2/20 0.43
GAA P10253 1/20 0.43
KLK7 P49862 1/20 0.43

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
SCHEMBL13869825 0.87 MAPT (0.62) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869702 0.87 MAPT (0.46) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869762 0.85 EP300 (0.45) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869811 0.80 MAPT (0.44) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869651 0.80 MAPT (0.48) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869826 0.80 CYP19A1 (0.65) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869488 0.79 CYP19A1 (0.64) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869289 0.78 ALDH1A1 (0.72) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869603 0.77 MAPT (0.41) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1
SCHEMBL13869582 0.77 MAPT (0.53) MAPTALDH1A1KDM4ESMN1; SMN2L3MBTL1

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
US-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 US disclosed
US-7514158-B2 Coumarin compound KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2009-04-07 US disclosed