SCHEMBL7569008

SCHEMBL7569008

CCC(NC(=O)c1cccc2cc3c(Cl)cccc3nc12)C(N)C(CC)NC(=O)c1cccc2cc3c(Cl)cccc3nc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
TAS1R2 Q8TE23 1/20 0.44
RAD52 P43351 1/20 0.41
TP53 P04637 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
TACR3 P29371 4/20 0.37
TACR2 P21452 2/20 0.37
PYGL P06737 1/20 0.36
AOX1 Q06278 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDR P35968 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
SCHEMBL7565793 0.88 MAPT (0.40) TAS1R3TAS1R1TP53RXFP1KMT2A
SCHEMBL7571929 0.87 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2KMT2AMEN1
SCHEMBL7566344 0.85 HDAC1 (0.48) TAS1R3TAS1R1TAS1R2RAD52KMT2A
SCHEMBL7566996 0.85 TAS1R3 (0.49) TAS1R3TAS1R1TAS1R2RAD52TP53
SCHEMBL7564769 0.85 RAD52 (0.59) TAS1R3TAS1R1TAS1R2RAD52TP53
SCHEMBL8413337 0.84 RAD52 (0.49) TAS1R3TAS1R1TAS1R2RAD52TP53
SCHEMBL7568076 0.83 AOX1 (0.45) TAS1R3TAS1R1TAS1R2RAD52TP53
SCHEMBL7566165 0.83 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2RAD52TP53
SCHEMBL7567031 0.82 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2RAD52TP53
SCHEMBL7565766 0.80 AOX1 (0.46) TAS1R3TAS1R1TAS1R2RAD52TP53

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