SCHEMBL7568056

SCHEMBL7568056

CNCCCNC(=O)c1cccc2nc3cccc(OC)c3nc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 4/20 0.61
SMARCA2 P51531 1/20 0.61
HPGD P15428 1/20 0.50
ADORA2A P29274 1/20 0.47
ADORA2B P29275 1/20 0.47
NQO2 P16083 2/20 0.46
NAMPT P43490 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
UHRF1 Q96T88 1/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HCRTR1 O43613 1/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
G6PD P11413 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 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
SCHEMBL8411929 0.87 KDM4E (0.50) RAD52SMARCA2HPGDKMT2AMEN1
SCHEMBL7573561 0.86 RAD52 (0.68) RAD52SMARCA2HPGDNQO2NAMPT
SCHEMBL29634211 0.84 RAD52 (0.85) RAD52SMARCA2HPGDNQO2UHRF1
SCHEMBL8224795 0.84 RAD52 (0.85) RAD52SMARCA2HPGDNQO2UHRF1
SCHEMBL7570872 0.83 RAD52 (0.51) RAD52SMARCA2HPGDMAPTALDH1A1
Hydrochloric Acid SCHEMBL10866302 0.83 RAD52 (0.87) RAD52SMARCA2HPGDNQO2KMT2A
SCHEMBL8415079 0.82 RAD52 (0.50) RAD52SMARCA2HPGDKMT2ASMN1; SMN2
SCHEMBL7566449 0.81 CYP1A2 (0.51) RAD52SMARCA2HPGDKMT2ASMN1; SMN2
SCHEMBL8009925 0.80 HPGD (0.49) RAD52SMARCA2HPGDKMT2AMEN1
SCHEMBL7998025 0.78 RAD52 (0.47) RAD52SMARCA2HPGDNQO2KMT2A

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 1 patent. 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