SCHEMBL9405141

SCHEMBL9405141

CCOC(=O)c1nc2ccc3nccnc3c2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 5/20 0.43
HPGD P15428 4/20 0.43
HTT P42858 1/20 0.43
RECQL P46063 1/20 0.43
PKN1 Q16512 1/20 0.39
PKN2 Q16513 1/20 0.39
CYP1A2 P05177 2/20 0.39
POLB P06746 3/20 0.39
GAA P10253 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MMP2 P08253 1/20 0.38
MMP13 P45452 1/20 0.38
MMP14 P50281 1/20 0.38
HSD17B10 Q99714 3/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL15330158 0.77 ALDH1A1 (0.49) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL9380265 0.71 MEN1 (0.48) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL29468686 0.71 MEN1 (0.48) KDM4EALDH1A1HPGDPOLBGAA
SCHEMBL31253221 0.71 KDM4E (0.50) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL10477389 0.70 ALOX15 (0.48) KDM4EALDH1A1HTTPOLBMAPT
SCHEMBL15465667 0.70 TSHR (0.56) KDM4EALDH1A1HTTCYP1A2POLB
SCHEMBL4296230 0.70 HSD17B10 (0.61) KDM4EALDH1A1HPGDRECQLCYP1A2
SCHEMBL7072038 0.69 KDM5A (0.48) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL2445509 0.69 GABRA1 (0.52) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL2445674 0.69 HRH4 (0.53) KDM4EALDH1A1HPGDHTTRECQL

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-0502885-B1 IMIDAZOQUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1994-06-01 EP disclosed
EP-0502885-A1 IMIDAZOQUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE. NOVO NORDISK AS (DK) 1992-09-16 EP disclosed
US-5102885-A Anticonvulsants, anxiolytic agents, cognition activators NOVO NORDISK A/S (DK) 1992-04-07 US disclosed
WO-1991007408-A1 IMIDAZOQUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1991-05-30 WO disclosed