SCHEMBL17355102

SCHEMBL17355102

Nc1cc(-c2ccccc2-c2ccccc2)n[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.51
HSD17B10 Q99714 2/20 0.46
MAP4K4 O95819 1/20 0.46
CSF1R P07333 1/20 0.46
FGFR1 P11362 1/20 0.46
PDGFRA P16234 1/20 0.46
LTK P29376 1/20 0.46
KDR P35968 1/20 0.46
MAPK8 P45983 1/20 0.46
CSNK1A1 P48729 1/20 0.46
LIMK1 P53667 1/20 0.46
CDK5 Q00535 1/20 0.46
ACVR1 Q04771 1/20 0.46
TNK2 Q07912 1/20 0.46
AURKB Q96GD4 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL168659 0.84 POLB (0.61) ADORA3PDGFRALIMK1CDK5AURKB
SCHEMBL1857868 0.78 NPC1 (0.54) ADORA3HSD17B10CLK4KDM4ENPC1
SCHEMBL3499089 0.78 ALPL (0.57) ADORA3HSD17B10KDM4ENPC1GAA
SCHEMBL28025294 0.78 POLB (0.48) ADORA3AURKBPOLBRAB9ALMNA
SCHEMBL17355073 0.78 ALOX15 (0.58) HSD17B10KDM4ENPC1GAARAB9A
SCHEMBL31324688 0.78 ALPL (0.57) ADORA3HSD17B10KDM4ENPC1GAA
SCHEMBL18803859 0.78 L3MBTL1 (0.72) ADORA3HSD17B10CSF1RAURKBKDM4E
SCHEMBL3502511 0.78 IDO1 (0.49) ADORA3HSD17B10KDM4ENPC1GAA
SCHEMBL2083395 0.78 IDO1 (0.49) ADORA3HSD17B10KDM4ENPC1GAA
SCHEMBL5261707 0.75 HDAC3 (0.45) HSD17B10MAP4K4CSF1RFGFR1PDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9969741-B2 Pyrazolotriazines as inhibitors of nucleases MASARYKOVA UNIVERZITA (CZ) 2018-05-15 US disclosed
US-9969741-B2 Pyrazolotriazines as inhibitors of nucleases MASARYKOVA UNIVERZITA (CZ) 2018-05-15 US disclosed
EP-2957562-B1 PYRAZOLOTRIAZINES AS INHIBITORS OF NUCLEASES UNIV MASARYKOVA (CZ) 2017-12-20 EP disclosed
US-20170197966-A1 PYRAZOLOTRIAZINES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2017-07-13 US disclosed
US-20170197966-A1 PYRAZOLOTRIAZINES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2017-07-13 US disclosed
EP-2957562-A1 Pyrazolotriazines as inhibitors of nucleases Masarykova univerzita (CZ) 2015-12-23 EP disclosed
WO-2015192817-A1 PYRAZOLOTRIAZINES AS INHIBITORS OF NUCLEASES MASARYKOVA UNIVERZITA (CZ) 2015-12-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170197966-A1 PYRAZOLOTRIAZINES AS INHIBITORS OF NUCLEASES DNASE1, TDP1, RNASEH1 ADORA3 1708/4885HSD17B10 2930/4885MAP4K4 3188/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.