SCHEMBL7809098

SCHEMBL7809098

O=C1c2cccnc2C(=O)c2c(F)ccc(F)c21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 4/20 0.59
NSD2 O96028 3/20 0.59
PAX8 Q06710 3/20 0.59
ABL1 P00519 1/20 0.59
PLCG1 P19174 1/20 0.59
CES1 P23141 1/20 0.59
RIN1 Q13671 1/20 0.59
MEN1 O00255 1/20 0.59
THRB P10828 1/20 0.59
BLM P54132 1/20 0.59
KMT2A Q03164 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
GAA P10253 1/20 0.59
S100A4 P26447 7/20 0.55
CDC25B P30305 3/20 0.55
PTPRC P08575 2/20 0.53
CTSL P07711 1/20 0.53
CTSS P25774 1/20 0.53
PTPN13 Q12923 1/20 0.53
PADI1 Q9ULC6 3/20 0.49

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
SCHEMBL7816501 0.91 S100A4 (0.54) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL7818534 0.91 S100A4 (0.54) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL7817043 0.80 ALDH1A1 (0.45) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL5915065 0.80 TDP2 (0.81) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL8545907 0.78 TDP2 (0.59) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL5915061 0.78 GAA (0.86) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL9267635 0.76 TDP2 (0.74) TDP2NSD2PAX8ABL1PLCG1
SCHEMBL3418850 0.75 MEN1 (0.55) TDP2PLCG1CES1MEN1THRB
SCHEMBL460433 0.75 TDP2 (1.00) TDP2NSD2PAX8ABL1PLCG1
Phanquone SCHEMBL462025 0.75 MEN1 (1.00) TDP2NSD2PAX8ABL1PLCG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0750619-B1 HETERO-ANNULATED INDAZOLES NOVUSPHARMA SPA (IT) 2001-05-30 EP disclosed
EP-0639183-B1 NITROGEN OXIDES OF AZA- AND DIAZA-ANTHRACENEDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS BOEHRINGER MANNHEIM ITALIA (IT) 1998-07-01 EP disclosed
US-5596097-A ANTITUMOR AGENTS THE UNIVERSITY OF VERMONT (US) 1997-01-21 US disclosed
EP-0750619-A1 HETERO-ANNULATED INDAZOLES BOEHRINGER MANNHEIM ITALIA S.p.A. (IT) 1997-01-02 EP disclosed
WO-1995024407-A1 HETERO-ANNULATED INDAZOLES BOEHRINGER MANNHEIM ITALIA, S.P.A. (IT) 1995-09-14 WO disclosed
EP-0639183-A1 NITROGEN OXIDES OF AZA- AND DIAZA-ANTHRACENEDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1995-02-22 EP disclosed
WO-1992015566-A1 NITROGEN OXIDES OF AZA- AND DIAZA-ANTHRACENEDIONE DERIVATIVES AS ANTITUMOR AGENTS BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1992-09-17 WO disclosed