SCHEMBL5080090

SCHEMBL5080090

C=CCNc1ncnc2c1ncn2C(O)(CC)COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
NPC1 O15118 3/20 0.40
HPGD P15428 3/20 0.40
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39
TP53 P04637 3/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CDK1 P06493 3/20 0.37
TMIGD3 P0DMS9 4/20 0.37
ADORA2A P29274 4/20 0.37
ADORA1 P30542 4/20 0.37
ADORA2B P29275 1/20 0.37
MAPT P10636 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36

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
SCHEMBL5080069 0.89 CDK1 (0.40) RAB9AHTTCDK1TMIGD3ADORA2A
SCHEMBL5086082 0.83 NPC1 (0.36) RAB9ASMN1; SMN2NPC1HPGDABL1
SCHEMBL5083000 0.82 ADORA1 (0.41) SMN1; SMN2ABL1RIN1ADORA2AADORA1
SCHEMBL5082973 0.81 ADORA1 (0.46) ABL1RIN1ADORA2AADORA1ADORA2B
SCHEMBL5083021 0.81 ADORA1 (0.47) ADORA2AADORA1ADORA2B
SCHEMBL5082276 0.79 SMN1; SMN2 (0.40) SMN1; SMN2TP53LMNAHTTALOX15
SCHEMBL5080087 0.73 ABL1 (0.42) RAB9ASMN1; SMN2NPC1HPGDABL1
SCHEMBL5083648 0.72 DNPH1 (0.37) CDK1TMIGD3ADORA2AADORA1ADORA2B
SCHEMBL5086065 0.68 ABL1 (0.38) RAB9ASMN1; SMN2NPC1HPGDABL1
SCHEMBL7644240 0.67 HTT (0.68) RAB9ASMN1; SMN2NPC1HPGDABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7388002-B2 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2008-06-17 US disclosed
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. (US) 2006-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060122391-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases POLR2H, NSUN2, POLR2E RAB9A 4162/4885SMN1; SMN2 655/4885NPC1 1383/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.