SCHEMBL15040035

SCHEMBL15040035

CSc1nc(=O)n(N)c(=O)n1Cc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.50
APOBEC3G Q9HC16 1/20 0.50
KMT2A Q03164 2/20 0.47
P2RX3 P56373 4/20 0.43
TSHR P16473 3/20 0.42
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 3/20 0.40
DRD2 P14416 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TYMS P04818 1/20 0.38
MEN1 O00255 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
SCHEMBL15039711 0.86 TSHR (0.57) KMT2AP2RX3TSHRALDH1A1MAPT
SCHEMBL10055104 0.81 P2RX3 (0.57) P2RX3
SCHEMBL9987765 0.76 P2RX3 (0.54) P2RX3
SCHEMBL10254173 0.75 MAPT (0.50) ATMAPOBEC3GKMT2AP2RX3TSHR
SCHEMBL9983147 0.73 ATM (0.60) ATMAPOBEC3GKMT2AP2RX3TSHR
SCHEMBL12047012 0.73 P2RX3 (0.63) P2RX3
SCHEMBL10254261 0.72 PROKR1 (0.53) P2RX3ALDH1A1MAPTKDM4E
SCHEMBL15039615 0.71 TSHR (0.58) P2RX3TSHR
SCHEMBL8280009 0.70 RGS4 (0.50) KMT2AP2RX3MAPTKDM4EMEN1
SCHEMBL15462257 0.70 RGS4 (0.51) P2RX3ALDH1A1MAPTNPSR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2604595-A1 TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY Shionogi&Co., Ltd. (JP) 2013-06-19 EP disclosed