SCHEMBL9078550

SCHEMBL9078550

Cc1c(N2CCNC3(CC3)C2)c(F)cc2c(=O)c(C(=O)O)cn(-c3ccc(F)cc3F)c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.46
TOP1 P11387 4/20 0.46
TOP2B Q02880 3/20 0.46
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 4/20 0.45
HSD17B10 Q99714 4/20 0.45
LMNA P02545 3/20 0.45
KCNH2 Q12809 2/20 0.44
KMT2A Q03164 2/20 0.44
EPHA2 P29317 1/20 0.43
FLT4 P35916 1/20 0.43
GSK3B P49841 1/20 0.43
RARB P10826 1/20 0.43
TBXAS1 P24557 1/20 0.43
SLC6A3 Q01959 1/20 0.43
POLB P06746 2/20 0.43
HSP90AA1 P07900 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
MEN1 O00255 1/20 0.42

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
SCHEMBL9078492 0.93 KDM4E (0.48) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9079450 0.90 TOP2A (0.46) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9080384 0.90 KDM4E (0.49) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9078811 0.90 KDM4E (0.49) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9079678 0.87 TOP2A (0.45) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9080289 0.84 KDM4E (0.60) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9079541 0.83 POLB (0.41) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL4369507 0.82 KCNH2 (0.50) TOP2ATOP1TOP2BKDM4EALDH1A1
SCHEMBL9078535 0.82 KDM4E (0.58) TOP2ATOP2BKDM4EALDH1A1HPGD
SCHEMBL9080772 0.82 KCNH2 (0.45) TOP2ATOP1TOP2BKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5508428-A Spiro compound DAIICHI PHAMACEUTICAL CO., LTD. (JP) 1996-04-16 US disclosed
US-5286723-A Spiro compound DAIICHI SEIYAKU CO., LTD. 1994-02-15 US disclosed
EP-0357047-B1 Spiro compounds DAIICHI SEIYAKU CO (JP) 1993-11-03 EP disclosed
EP-0529688-A2 Azaspiro n,m alkanes and diazaspiro n,m -alkanes DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1993-03-03 EP disclosed
EP-0357047-A1 Spiro compounds DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1990-03-07 EP disclosed