SCHEMBL7710462

SCHEMBL7710462

CN(C)/C=N/C(=O)c1ccc(/N=C/N(C)C)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.40
HPGD P15428 4/20 0.40
RAB9A P51151 4/20 0.40
MAPT P10636 3/20 0.40
NPC1 O15118 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 11/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HTT P42858 2/20 0.39
POLB P06746 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
RECQL P46063 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
GAA P10253 1/20 0.37
CYP3A4 P08684 1/20 0.35

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
SCHEMBL7710467 1.00 SMN1; SMN2 (0.40) SMN1; SMN2HPGDRAB9AMAPTNPC1
SCHEMBL29248099 0.84 P4HA1 (0.46) SMN1; SMN2HPGDRAB9AMAPTNPC1
SCHEMBL29114321 0.84 P4HA1 (0.46) SMN1; SMN2HPGDRAB9AMAPTNPC1
SCHEMBL18614535 0.80 DGAT1 (0.54) SMN1; SMN2HPGDRAB9AMAPTNPC1
SCHEMBL18614534 0.80 DGAT1 (0.54) SMN1; SMN2HPGDRAB9AMAPTNPC1
SCHEMBL21431824 0.73 HCAR2 (0.47) SMN1; SMN2HPGDRAB9ANPC1NPSR1
SCHEMBL21408786 0.73 HCAR2 (0.47) SMN1; SMN2HPGDRAB9ANPC1NPSR1
SCHEMBL11259705 0.72 ALDH1A1 (0.49) RAB9AMAPTNPSR1HSD17B10ALDH1A1
SCHEMBL11259703 0.72 ALDH1A1 (0.49) RAB9AMAPTNPSR1HSD17B10ALDH1A1
SCHEMBL4901313 0.72 CYP1A2 (0.49) SMN1; SMN2HPGDRAB9AMAPTNPC1

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
US-6362191-B1 ANTIBIOTICS ZENECA LTD. (GB) 2002-03-26 US disclosed
EP-1007525-A1 AMINOMETYL OXOOXAZOLIDINYL BENZENE DERIVATIVES ZENECA LIMITED (GB) 2000-06-14 EP disclosed
WO-1999011642-A1 AMINOMETYL OXOOXAZOLIDINYL BENZENE DERIVATIVES ZENECA LIMITED (GB) 1999-03-11 WO disclosed