SCHEMBL7566479

SCHEMBL7566479

CCC(NC(=O)c1cccc2cc3ccc(N(C)C)cc3nc12)C(N)C(CC)NC(=O)c1cccc2cc3ccc(N(C)C)cc3nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOX1 Q06278 1/20 0.42
TERT O14746 1/20 0.39
APP P05067 1/20 0.39
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
RAD52 P43351 2/20 0.35
TACR3 P29371 1/20 0.35
PARP1 P09874 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
TAS1R2 Q8TE23 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TEAD4 Q15561 1/20 0.33
RAB9A P51151 2/20 0.32
KDM4E B2RXH2 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL7566344 0.87 HDAC1 (0.48) AOX1HDAC1HDAC6KMT2AMEN1
SCHEMBL7566165 0.86 TAS1R3 (0.39) AOX1HDAC1HDAC6KMT2AMEN1
SCHEMBL7564033 0.86 HDAC1 (0.40) AOX1HDAC1HDAC6TACR3PARP1
SCHEMBL7572103 0.86 AOX1 (0.39) AOX1HDAC1HDAC6TACR3PARP1
SCHEMBL8415065 0.86 AOX1 (0.47) AOX1TERTAPPHDAC1HDAC6
SCHEMBL7567197 0.84 KDM4E (0.48) KMT2AMEN1PARP1TAS1R3TAS1R1
SCHEMBL7565752 0.84 FGFR4 (0.38) AOX1HDAC1HDAC6PARP1TAS1R3
SCHEMBL7565766 0.81 AOX1 (0.46) AOX1HDAC1HDAC6KMT2AMEN1
SCHEMBL7567962 0.80 TERT (0.39) AOX1TERTHDAC1HDAC6KMT2A
SCHEMBL7564172 0.80 TAS1R3 (0.41) AOX1HDAC1HDAC6KMT2AMEN1

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