SCHEMBL7024435

SCHEMBL7024435

CN(C)CCNC(=O)c1cccc2cc3cc(-c4ccccc4)ccc3nc12

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AOX1 Q06278 1/20 0.74
RAD52 P43351 7/20 0.61
UHRF1 Q96T88 2/20 0.53
SMARCA2 P51531 1/20 0.53
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
MOK Q9UQ07 1/20 0.48
CHEK1 O14757 1/20 0.47
MCHR1 Q99705 1/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47
POLR1A O95602 2/20 0.46
ECE1 P42892 1/20 0.46
MUS81 Q96NY9 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAP4K4 O95819 1/20 0.46

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
SCHEMBL7570920 0.89 AOX1 (0.60) AOX1RAD52HDAC1HDAC6KDM4E
SCHEMBL29369424 0.87 AOX1 (0.78) AOX1RAD52UHRF1SMARCA2HDAC1
SCHEMBL105276 0.87 AOX1 (0.78) AOX1RAD52UHRF1SMARCA2HDAC1
Hydrochloric Acid SCHEMBL29608361 0.86 AOX1 (0.77) AOX1RAD52UHRF1SMARCA2HDAC1
Hydrochloric Acid SCHEMBL4888175 0.86 AOX1 (0.77) AOX1RAD52UHRF1SMARCA2HDAC1
Hydrochloric Acid SCHEMBL5953779 0.85 AOX1 (0.75) AOX1RAD52UHRF1SMARCA2HDAC1
SCHEMBL7027447 0.84 AOX1 (0.78) AOX1RAD52UHRF1SMARCA2HDAC1
SCHEMBL7026713 0.83 AOX1 (0.76) AOX1RAD52UHRF1SMARCA2HDAC1
SCHEMBL7028197 0.83 AOX1 (0.74) AOX1RAD52UHRF1SMARCA2HDAC1
SCHEMBL7031148 0.83 AOX1 (0.74) AOX1RAD52UHRF1SMARCA2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934277-B1 PROCESS FOR THE PREPARATION OF N- 2-(DIMETHYLAMINO)ETHYL]ACRIDINE-4-CARBOXAMIDE XENOVA LTD (GB) 2003-02-05 EP disclosed
US-6111109-A CYCLIZING A 2-(2-ALKYLOXYCARBONYLPHENYL)AMINO-)BENZALDEHYDE BY TREATING WITH A BORON TRIFLUORIDE; NEUTRALIZATION OF THE FORMED SALT; AMIDATION WITH AN 2-N,N-DIALKYLAMINOETHYLAMINE;ANTITUMOR AND -CARCINOGENIC XENOVA LIMITED (GB) 2000-08-29 US disclosed
EP-0934277-A1 PROCESS FOR THE PREPARATION OF N- 2-(DIMETHYLAMINO)ETHYL]ACRIDINE-4-CARBOXAMIDE XENOVA LIMITED (GB) 1999-08-11 EP disclosed
WO-1998017649-A1 PROCESS FOR THE PREPARATION OF N-[2-(DIMETHYLAMINO)ETHYL]ACRIDINE-4-CARBOXAMIDE XENOVA LIMITED (GB) 1998-04-30 WO disclosed