SCHEMBL6624281

SCHEMBL6624281

COC(=O)c1cccc2c1[nH]c1ccc3ccnc(Cl)c3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM3 Q86V86 3/20 0.42
PIM1 P11309 2/20 0.42
PSMD14 O00487 1/20 0.41
NR4A2 P43354 3/20 0.40
MPL P40238 1/20 0.39
JAK2 O60674 1/20 0.39
PKN1 Q16512 1/20 0.38
PKN2 Q16513 1/20 0.38
MAP2K1 Q02750 1/20 0.38
PBRM1 Q86U86 1/20 0.38
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 2/20 0.37
ATR Q13535 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HSD17B10 Q99714 1/20 0.37
DYRK1A Q13627 1/20 0.36

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
SCHEMBL6624979 0.80 MAPK8 (0.45) PIM3PIM1PSMD14NR4A2MPL
SCHEMBL28892330 0.78 ATR (0.46) PSMD14NR4A2PKN1PKN2KDM4E
SCHEMBL6629158 0.77 PIM3 (0.46) PIM3PIM1NR4A2MPLJAK2
SCHEMBL6622666 0.73 LMNA (0.50) PIM3PIM1NR4A2MPLJAK2
SCHEMBL16735228 0.71 PSMD14 (0.54) PIM1PSMD14NR4A2MAP2K1KDM4E
SCHEMBL8487413 0.71 JAK2 (0.52) PIM3PIM1NR4A2MPLJAK2
SCHEMBL23885517 0.70 PIM3 (0.47) PIM3PIM1PSMD14NR4A2JAK2
SCHEMBL3612956 0.70 NR4A2 (0.51) PIM3PIM1NR4A2MPLJAK2
SCHEMBL30052204 0.70 PIM3 (0.47) PIM3PIM1PSMD14NR4A2JAK2
SCHEMBL9485757 0.70 MPL (0.61) PIM3PIM1NR4A2MPLPBRM1

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
EP-0831094-B1 FUSED POLYCYCLIC HETEROCYCLE DERIVATIVES EISAI CO LTD (JP) 2004-12-08 EP disclosed
US-5952335-A ANTITUMOR AGENTS EISAI CO., LTD. (JP) 1999-09-14 US disclosed
EP-0831094-A1 FUSED POLYCYCLIC HETEROCYCLE DERIVATIVES Eisai Co., Ltd. (JP) 1998-03-25 EP disclosed