SCHEMBL8783754

SCHEMBL8783754

COC(=O)c1ccc(N[C@H]2CCc3cc4nc(C)n(COC(=O)C(C)(C)C)c(=O)c4cc32)cn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 1/20 0.34
PIK3CA P42336 4/20 0.33
EIF4EBP1 Q13541 4/20 0.32
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
NPC1 O15118 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
HSD17B10 Q99714 2/20 0.30
DDB1 Q16531 1/20 0.30
CRBN Q96SW2 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 1/20 0.30
TLR7 Q9NYK1 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C8 P10632 1/20 0.30

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
SCHEMBL8783752 1.00 PDE7A (0.34) PDE7APIK3CAEIF4EBP1KDM4EMEN1
SCHEMBL6949031 0.93 KDM4E (0.35) PIK3CAEIF4EBP1KDM4EMEN1KMT2A
SCHEMBL6949037 0.93 KDM4E (0.35) PIK3CAEIF4EBP1KDM4EMEN1KMT2A
SCHEMBL8783765 0.84 KMT2A (0.30) KMT2A
SCHEMBL8783772 0.84 KMT2A (0.30) KMT2A
SCHEMBL8784371 0.81 EIF4EBP1 (0.31) EIF4EBP1KDM4EMEN1KMT2APOLB
SCHEMBL8783782 0.81 GPR119 (0.31)
SCHEMBL8783780 0.81 GPR119 (0.31)
SCHEMBL8784802 0.81 P2RX3 (0.36) EIF4EBP1KDM4EMEN1KMT2APOLB
SCHEMBL8784811 0.81 P2RX3 (0.36) EIF4EBP1KDM4EMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758328-A1 ANTI-CANCER COMPOUNDS CONTAINING CYCLOPENTAQUINAZOLINE RING BTG INTERNATIONAL LIMITED (GB) 1997-02-19 EP disclosed
WO-1995030673-A1 ANTI-CANCER COMPOUNDS CONTAINING CYCLOPENTAQUINAZOLINE RING BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-11-16 WO disclosed
EP-0667864-A1 TRICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY. ZENECA LTD (GB) 1995-08-23 EP disclosed
WO-1994011354-A1 TRICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY ZENECA LIMITED (GB) 1994-05-26 WO disclosed