SCHEMBL7898211

SCHEMBL7898211

O=C(COc1ccccc1)Nc1nc2c(ncn2[C@H]2C[C@H](O)[C@@H](COC(=O)c3ccc([N+](=O)[O-])cc3)O2)c(=O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 1/20 0.43
TYMP P19971 1/20 0.42
POLA1 P09884 1/20 0.42
POLB P06746 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
TYMS P04818 1/20 0.41
PNP P00491 1/20 0.41
KDM4E B2RXH2 1/20 0.40
P2RY2 P41231 1/20 0.40
P2RY4 P51582 1/20 0.40
P2RY6 Q15077 1/20 0.40
GSK3A P49840 1/20 0.38
RPS6KA3 P51812 1/20 0.38
MAPK14 Q16539 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.37
HINT1 P49773 1/20 0.37

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
SCHEMBL7040477 0.85 SLC29A1 (0.57) SLC29A1
SCHEMBL9446434 0.84 POLA1 (0.58) TYMPPOLA1POLBTAS1R3TAS1R1
SCHEMBL7038107 0.84 POLA1 (0.58) TYMPPOLA1POLBTAS1R3TAS1R1
SCHEMBL7896654 0.83 POLB (0.58) SLC29A1TYMPPOLA1POLBTAS1R3
SCHEMBL6892233 0.83 TAS1R3 (0.41) SLC29A1TYMPPOLA1POLBTAS1R3
SCHEMBL7873183 0.81 KDM4E (0.58) TYMPPOLA1POLBTAS1R3TAS1R1
SCHEMBL3511836 0.81 KDM4E (0.58) TYMPPOLA1POLBTAS1R3TAS1R1
SCHEMBL3418307 0.81 KDM4E (0.58) TYMPPOLA1POLBTAS1R3TAS1R1
SCHEMBL3418302 0.81 KDM4E (0.58) TYMPPOLA1POLBTAS1R3TAS1R1
SCHEMBL13031161 0.78 TYMP (0.53) TYMPPOLA1POLBTAS1R3TAS1R1

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
US-6187914-B1 SOLID PHASE SYNTHESIS OF OLIGONUCLEOTIDES USING ELECTROCHEMICALLY LABILE PROTECTING GROUPS WHICH CAN BE REMOVED BY CREATING POTENTIAL DIFFERENCE BETWEEN WORKING ELECTRODE AND COUNTERELECTRODE CIS BIO INTERNATIONAL (FR) 2001-02-13 US disclosed