SCHEMBL2776067

SCHEMBL2776067

Nc1nc(N2CCOCC2)c2[nH]c(N)nc2n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NUDT1 P36639 1/20 0.46
▸ PIK3CA P42336 7/20 0.45
▸ MTOR P42345 5/20 0.45
▸ MEN1 O00255 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NOS1 P29475 2/20 0.43
▸ IKBKB O14920 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ MAP2K7 O14733 1/20 0.41
▸ HRH4 Q9H3N8 1/20 0.40
▸ PRKDC P78527 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CRHBP P24387 1/20 0.39
▸ CRHR2 Q13324 1/20 0.39
▸ XDH P47989 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
SCHEMBL13650791 0.74 CTSK (0.61) NUDT1POLBNOS1IKBKBGAA
SCHEMBL19548102 0.71 NUDT1 (0.63) NUDT1PIK3CAMTORPOLBNOS1
SCHEMBL13650825 0.71 MAPT (0.54) NUDT1PIK3CAMTORPOLBNOS1
SCHEMBL13650785 0.71 NUDT1 (0.54) NUDT1PIK3CAMTORPOLBNOS1
SCHEMBL18194315 0.70 PIK3CA (0.62) NUDT1PIK3CAMTORPOLBNOS1
SCHEMBL3657011 0.70 PNP (0.54) PIK3CAMTORMEN1POLBKMT2A
Hydrochloric Acid SCHEMBL17822432 0.69 NUDT1 (0.61) NUDT1PIK3CAMTORPOLBNOS1
SCHEMBL9643516 0.69 GAA (0.56) NUDT1PIK3CAMTORPOLBNOS1
SCHEMBL25252135 0.69 NUDT1 (0.47) NUDT1NOS1MAP2K7HRH4CRHBP
SCHEMBL3765089 0.69 NOS1 (0.59) NUDT1PIK3CAMTORNOS1IKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790877-B2 Antisense oligonucleotides with increased RNase sensitivity GEN-PROBE, INCORPORATED (US) 2010-09-07 — — US disclosed
EP-1019539-A4 COMBINATORIAL ANTISENSE LIBRARY GEN PROBE INC (US) 2005-03-09 — — EP disclosed
EP-1019539-A1 COMBINATORIAL ANTISENSE LIBRARY Oasis Biosciences, Inc. (US) 2000-07-19 — — EP disclosed
WO-1999018238-A1 COMBINATORIAL ANTISENSE LIBRARY OASIS BIOSCIENCES, INC. (US) 1999-04-15 — — WO disclosed
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