SCHEMBL11245765

SCHEMBL11245765

CSc1nc(N)nc2c1ncn2COCCO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 7/20 0.56
HBB P68871 2/20 0.56
USP2 O75604 1/20 0.56
TSHR P16473 1/20 0.56
EDNRA P25101 1/20 0.56
HTR2A P28223 1/20 0.56
RECQL P46063 1/20 0.56
BLM P54132 1/20 0.56
HSD17B10 Q99714 1/20 0.56
CYP2C19 P33261 3/20 0.45
HK1 P19367 1/20 0.45
HKDC1 Q2TB90 1/20 0.45
SLC29A1 Q99808 1/20 0.44
HPRT1 P00492 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL10405077 0.83 HK1 (0.44) PNPHBBUSP2TSHREDNRA
SCHEMBL571583 0.83 PNP (0.62) PNPHBBUSP2TSHREDNRA
Acyclovir SCHEMBL9828560 0.82 PNP (0.61) PNPHBBUSP2TSHREDNRA
Hydrochloric Acid SCHEMBL11250267 0.82 PNP (0.61) PNPHBBUSP2TSHREDNRA
SCHEMBL9583333 0.81 HIF1A (0.56) BLMCYP2C19HK1HKDC1SLC29A1
SCHEMBL11724984 0.81 PNP (0.60) PNPHBBUSP2TSHREDNRA
SCHEMBL10585595 0.81 PNP (0.60) PNPHBBUSP2TSHREDNRA
SCHEMBL11251829 0.80 PNP (0.56) PNPHBBUSP2TSHREDNRA
SCHEMBL23247753 0.80 PNP (0.56) PNPHBBUSP2TSHREDNRA
SCHEMBL29767910 0.80 PNP (0.56) PNPHBBUSP2TSHREDNRA

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 6 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-4287188-A PARTICULARLY 9-(2-HYDROXYETHOXYMETHYL) GUANINE MONOPHOSPHATE AND SALTS, USEFUL AS ANTIVIRIAL AGENTS BURROUGHS WELLCOME CO. (US) 1981-09-01 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