SCHEMBL2229906

SCHEMBL2229906

NC(=O)Nc1nc(N)nc(-c2ccccc2)n1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.56
ADORA1 P30542 3/20 0.56
ADORA3 P0DMS8 2/20 0.56
ADORA2A P29274 2/20 0.56
ADORA2B P29275 2/20 0.56
POLB P06746 1/20 0.56
CYP1A2 P05177 1/20 0.51
TPH1 P17752 7/20 0.50
TSHR P16473 3/20 0.49
USP2 O75604 1/20 0.49
ALOX15 P16050 2/20 0.47
GPR68 Q15743 3/20 0.47
HTR1A P08908 1/20 0.47
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
HRH4 Q9H3N8 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43

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
Benzoguanamine SCHEMBL8849771 0.97 ADORA1 (0.61) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL3945635 0.86 ADORA1 (0.60) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL6832263 0.84 CYP1A2 (0.51) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL7978560 0.83 NPSR1 (0.52) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL6982880 0.83 TPH1 (0.56) NPSR1ADORA1ADORA3ADORA2AADORA2B
Benzoguanamine SCHEMBL5162725 0.81 ADORA2A (0.79) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL1149978 0.80 ADORA2A (0.64) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL11807135 0.79 TSHR (0.61) NPSR1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL8413034 0.78 HDAC1 (0.56) ADORA1ADORA3POLBTSHRUSP2
SCHEMBL14058517 0.78 ADORA2A (0.67) NPSR1ADORA1ADORA3ADORA2AADORA2B

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-8174648-B2 Cellulose acylate film, process for producing the same, and polarizing plate and liquid crystal display device having the same FUJIFILM CORPORATION (JP) 2012-05-08 US disclosed
US-20110181812-A1 CELLULOSE ACYLATE FILM, PROCESS FOR PRODUCING THE SAME, AND POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE HAVING THE SAME FUJIFILM CORPORATION (JP) 2011-07-28 US disclosed
US-20100027116-A1 ANTIGLARE FILM, POLARIZING PLATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2010-02-04 US disclosed