SCHEMBL5137072

SCHEMBL5137072

Sc1nc2cnc3ccccc3c2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
GPR3 P46089 1/20 0.46
TOP2A P11388 3/20 0.41
GABRA1 P14867 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRA6 Q16445 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TOP2B Q02880 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
SCHEMBL842044 0.79 QTRT1 (0.51) KDM4EGPR3TOP2AGABRA1GABRG2
SCHEMBL311958 0.79 PARP1 (0.51) KDM4EGPR3TOP2ANPC1ALDH1A1
SCHEMBL311168 0.79 KDM4E (0.46) KDM4EGPR3TOP2AGABRA1GABRG2
SCHEMBL1486423 0.77 KDM4E (0.44) KDM4EGPR3TOP2AGABRA1GABRG2
SCHEMBL1423662 0.76 TNKS (0.56) TOP2ANPC1ALDH1A1HPGDRAB9A
SCHEMBL2088588 0.75 ERN1 (0.45) KDM4EGPR3TOP2AGABRA1GABRG2
SCHEMBL5338042 0.75 KDM4E (0.42) KDM4EGPR3TOP2AHDAC6RAB9A
SCHEMBL9603222 0.75 PKM (0.55) KDM4EGPR3TOP2AGABRA1GABRG2
SCHEMBL203874 0.75 MAPK14 (0.42) KDM4EGPR3TOP2AALDH1A1HPGD
SCHEMBL5341134 0.75 LOXL2 (0.42) KDM4EGPR3TOP2AGABRA1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948173-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS Coley Pharmaceutical Group, Inc. (US) 2008-07-30 EP disclosed
WO-2007056112-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-05-18 WO disclosed