SCHEMBL7564172

SCHEMBL7564172

CCC(NC(=O)c1cccc2cc3cccc(C)c3nc12)C(N)C(CC)NC(=O)c1cccc2cc3cccc(C)c3nc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.41
TAS1R1 Q7RTX1 2/20 0.41
CD38 P28907 2/20 0.40
AOX1 Q06278 1/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
ATM Q13315 3/20 0.38
MAPT P10636 5/20 0.37
KDM4E B2RXH2 3/20 0.37
HTT P42858 2/20 0.37
CASP1 P29466 2/20 0.37
CASP7 P55210 2/20 0.37
HSD17B10 Q99714 2/20 0.37
PABPC1 P11940 1/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPK1 P28482 2/20 0.37
POLB P06746 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL7573598 0.91 TAS1R3 (0.38) TAS1R3TAS1R1CD38AOX1TAS1R2
SCHEMBL7567962 0.88 TERT (0.39) TAS1R3TAS1R1CD38AOX1TAS1R2
SCHEMBL7565911 0.87 RAD52 (0.39) TAS1R3TAS1R1CD38AOX1TAS1R2
SCHEMBL7571929 0.87 TAS1R3 (0.48) TAS1R3TAS1R1CD38AOX1TAS1R2
SCHEMBL7567229 0.87 TAS1R3 (0.37) TAS1R3TAS1R1CD38AOX1TAS1R2
SCHEMBL7565793 0.86 MAPT (0.40) TAS1R3TAS1R1CD38AOX1PDE3B
SCHEMBL7567278 0.86 AOX1 (0.38) TAS1R3TAS1R1AOX1TAS1R2ATM
SCHEMBL7566738 0.86 MAPT (0.48) TAS1R3TAS1R1TAS1R2ATMMAPT
SCHEMBL7566344 0.86 HDAC1 (0.48) TAS1R3TAS1R1AOX1TAS1R2MAPT
SCHEMBL7565944 0.85 TAS1R3 (0.46) TAS1R3TAS1R1PDE3BPDE3AALDH1A1

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-0934278-B1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LTD (GB) 2002-09-04 EP claimed
EP-0934278-B1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LTD (GB) 2002-09-04 EP disclosed
US-6114332-A BACTERICIDES XENOVA LIMITED (GB) 2000-09-05 US disclosed