SCHEMBL11256321

SCHEMBL11256321

CSc1ncnc2c1nc(N)n2COCCO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 4/20 0.49
TSHR P16473 2/20 0.37
USP2 O75604 1/20 0.37
EDNRA P25101 1/20 0.37
HTR2A P28223 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
HBB P68871 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ADORA2A P29274 5/20 0.36
ADORA2B P29275 5/20 0.36
ADORA1 P30542 5/20 0.36
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 1/20 0.35
ADORA3 P0DMS8 2/20 0.34
HTT P42858 1/20 0.34
TP53 P04637 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPK1 P28482 1/20 0.32
HSPA5 P11021 1/20 0.31

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
SCHEMBL9740954 0.68 PNP (0.59) PNPTSHRUSP2EDNRAHTR2A
SCHEMBL11245765 0.68 PNP (0.56) PNPTSHRUSP2EDNRAHTR2A
SCHEMBL8184815 0.66 PNP (0.50) PNPTSHRUSP2EDNRAHTR2A
SCHEMBL14201628 0.66 RET (0.40) HTTHSPA8
SCHEMBL11251829 0.62 PNP (0.56) PNPTSHRUSP2EDNRAHTR2A
SCHEMBL2293269 0.62 ADORA2A (0.66) PNPTSHRUSP2EDNRAHTR2A
SCHEMBL11281534 0.62 FBP1 (0.40) PNPTSHRHSD17B10KMT2AMAPK1
SCHEMBL6434440 0.61 PNP (0.50) PNPTSHRUSP2EDNRAHTR2A
SCHEMBL9583296 0.60 CYP1A2 (0.46) TSHRBLMHSD17B10ADORA2AADORA2B
SCHEMBL10563489 0.60 FDPS (0.50) PNPTSHRUSP2EDNRAHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4360522-A VIRICIDES BURROUGHS WELLCOME CO. (US) 1982-11-23 US disclosed
US-4323573-A VIRICIDES BURROUGHS WELLCOME CO. (US) 1982-04-06 US disclosed
US-4294831-A ANTIVIRAL ACTIVITY BURROUGHS WELLCOME CO. (US) 1981-10-13 US disclosed
US-4199574-A Methods and compositions for treating viral infections and guanine acyclic nucleosides BURROUGHS WELLCOME CO. (US) 1980-04-22 US disclosed
US-4146715-A ANTIVIRAL AGENTS BURROUGHS WELLCOME CO. (US) 1979-03-27 US disclosed