SCHEMBL7546071

SCHEMBL7546071

COc1cc(Cl)ccc1C(=O)c1ccnc(N)c1C(=O)Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
RORB Q92753 2/20 0.40
MAPK1 P28482 1/20 0.39
ABL1 P00519 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
JAK2 O60674 1/20 0.38
PYGL P06737 1/20 0.38
MAPK13 O15264 1/20 0.38
MAPK12 P53778 1/20 0.38
MAPK11 Q15759 1/20 0.38
MAPK14 Q16539 1/20 0.38
KCNMA1 Q12791 2/20 0.38
POLB P06746 2/20 0.37
NPC1 O15118 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL7553937 0.90 ALDH1A1 (0.43) FLT1FLT4KDRRORBMAPK1
SCHEMBL8798631 0.84 RORB (0.47) RORBRAB9AMAPK13MAPK12MAPK11
SCHEMBL7549213 0.84 L3MBTL1 (0.41) FLT1FLT4KDRABL1MAPT
SCHEMBL8805528 0.81 MAPK14 (0.40) MAPK1MAPTJAK2MAPK13MAPK12
SCHEMBL8804801 0.81 RECQL (0.46) RORBRAB9AJAK2POLBNPC1
SCHEMBL8692501 0.75 FLT1 (0.41) FLT1FLT4KDRRORBMAPK1
SCHEMBL7544426 0.74 HPGD (0.42) MAPTRAB9APYGLMAPK13MAPK12
SCHEMBL7546982 0.74 SCN10A (0.36) KDRMAPK1MAPTJAK2MAPK13
SCHEMBL1423874 0.73 FLT1 (0.55) FLT1FLT4KDRABL1MAPT
SCHEMBL7554905 0.73 L3MBTL1 (0.41) FLT1FLT4KDRRAB9AJAK2

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
WO-1997049708-A9 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS 1998-05-22 WO disclosed
EP-0811008-A1 BICYCLIC BENZAZEPINE DERIVATIVES AS VASOPRESSIN ANTAGONISTS American Cyanamid Company (US) 1997-12-10 EP disclosed
EP-0804420-A1 TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS American Cyanamid Company (US) 1997-11-05 EP disclosed