SCHEMBL18512866

SCHEMBL18512866

CO[C@H]1[C@@H](O)[C@@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.61
HINT1 P49773 5/20 0.59
NT5E P21589 1/20 0.57
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54
GSK3A P49840 2/20 0.54
RPS6KA3 P51812 2/20 0.54
MAPK14 Q16539 2/20 0.54
PNP P00491 2/20 0.53
ADORA2A P29274 1/20 0.53
ADORA2B P29275 1/20 0.53
TGM2 P21980 1/20 0.53
PAX8 Q06710 1/20 0.51

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
SCHEMBL1744361 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL222316 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL12031119 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL16198946 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL12150640 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL12300426 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL16360143 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL3713950 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
SCHEMBL26515 1.00 HPGD (0.61) HPGDHINT1NT5ETAS1R3TAS1R1
Water SCHEMBL25345533 0.99 HPGD (0.60) HPGDHINT1NT5ETAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023183569-A1 METHODS AND APPARATUS FOR SYNTHESIZING NUCLEIC ACIDS Molecular Assemblies, Inc. (US) 2023-09-28 WO disclosed
US-11339441-B2 Profiling chemically modified DNA/RNA units for disease and cancer diagnosis THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2022-05-24 US disclosed
US-20170044619-A1 PROFILING CHEMICALLY MODIFIED DNA/RNA UNITS FOR DISEASE AND CANCER DIAGNOSIS THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK 2017-02-16 US disclosed