SCHEMBL17461707

SCHEMBL17461707

CC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@@H](OC)C1OP(C)(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 1/20 0.54
▸ HINT1 P49773 4/20 0.52
▸ TGM2 P21980 1/20 0.51
▸ TAS1R3 Q7RTX0 1/20 0.50
▸ TAS1R1 Q7RTX1 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ FUT5 Q11128 1/20 0.49
▸ IMPDH2 P12268 1/20 0.47
▸ IMPDH1 P20839 1/20 0.47
▸ KRAS P01116 5/20 0.47
▸ GSK3A P49840 2/20 0.46
▸ RPS6KA3 P51812 2/20 0.46
▸ MAPK14 Q16539 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ HPRT1 P00492 1/20 0.45

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
SCHEMBL21344309 0.94 NT5E (0.55) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL15832464 0.93 HPGD (0.56) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL33190 0.92 NT5E (0.53) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL12015141 0.92 NT5E (0.53) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL12590073 0.92 NT5E (0.53) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL16587690 0.90 HINT1 (0.57) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL12015139 0.90 HINT1 (0.57) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL12015142 0.90 HINT1 (0.51) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL12590077 0.90 HINT1 (0.51) NT5EHINT1TGM2TAS1R3TAS1R1
SCHEMBL33175 0.90 HINT1 (0.51) NT5EHINT1TGM2TAS1R3TAS1R1

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
EP-2386636-B1 ENA NUCLEIC ACID DRUGS MODIFYING SPLICING IN MRNA PRECURSOR MATSUO MASAFUMI (JP) 2016-01-27 — — EP disclosed
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