SCHEMBL7353145

SCHEMBL7353145

O=c1[nH]c2ccccc2n2c(=O)[nH]nc12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.72
RXFP1 Q9HBX9 1/20 0.72
POLB P06746 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
G6PD P11413 1/20 0.54
PKM P14618 1/20 0.54
HPGD P15428 1/20 0.54
ALOX12 P18054 1/20 0.54
HKDC1 Q2TB90 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ADORA3 P0DMS8 11/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
GAA P10253 1/20 0.50
GFER P55789 1/20 0.50
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 0.48
PARP1 P09874 1/20 0.45

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
SCHEMBL8910786 0.78 DAO (0.49) NPSR1RXFP1KDM4EADORA3MEN1
SCHEMBL7418199 0.78 DAO (0.49) NPSR1RXFP1ADORA3ADORA2AADORA1
SCHEMBL7351886 0.78 PDE5A (0.50) NPSR1RXFP1ADORA3MEN1KMT2A
SCHEMBL7347754 0.75 PDE5A (0.50) NPSR1RXFP1ALDH1A1MAPTMEN1
SCHEMBL7413505 0.75 NPSR1 (0.44) NPSR1RXFP1KDM4EALDH1A1MAPT
SCHEMBL7353512 0.74 GRIA1 (0.50) NPSR1RXFP1ALDH1A1MAPTADORA3
SCHEMBL22045238 0.73 NPSR1 (0.55) NPSR1RXFP1POLBKDM4EALDH1A1
SCHEMBL14361375 0.72 POLB (0.68) NPSR1RXFP1POLBKDM4EALDH1A1
SCHEMBL8138057 0.71 HAVCR2 (0.49) NPSR1RXFP1KDM4EALDH1A1HPGD
SCHEMBL29948249 0.71 HAVCR2 (0.49) NPSR1RXFP1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633885-A1 TRIAZOLOQUINOXALIN-1,4-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1995-01-18 EP claimed
WO-1993006103-A1 TRIAZOLOQUINOXALIN-1,4-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-04-01 WO claimed
US-5504085-A TREATING ISCHEMIA, ANOXIA, HYPOGLYCEMIA AND HEAD, SPINAL CORD TRAUMA NOVO NORDISK A/S (DK) 1996-04-02 US disclosed
EP-0633885-A1 TRIAZOLOQUINOXALIN-1,4-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1995-01-18 EP disclosed
WO-1993006103-A1 TRIAZOLOQUINOXALIN-1,4-DIONES AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1993-04-01 WO disclosed
US-4668678-A ANTIALLERGENS USV PHARMACEUTICAL CORPORATION (US) 1987-05-26 US disclosed
US-4507300-A Pyridotriazolopyrazine-diones for treating allergy USV PHARMACEUTICAL CORPORATION (US) 1985-03-26 US disclosed
US-4400382-A Thiazoloquinoxalin-1,4-diones for treating allergy USV PHARMACEUTICAL CORPORATION (US) 1983-08-23 US disclosed
EP-0039920-A2 Triazaloquinoxalin-1,4-diones USV PHARMACEUTICAL CORPORATION (US) 1981-11-18 EP disclosed