SCHEMBL19987160

SCHEMBL19987160

CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4)ncnc32)C(F)C1(C)COP(=O)(N[C@@H](C)C(=O)OC(C)C)Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DNPH1 O43598 1/20 0.46
NT5E P21589 2/20 0.44
P2RX3 P56373 1/20 0.44
P2RX2 Q9UBL9 1/20 0.44
ADORA3 P0DMS8 7/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
TSHR P16473 1/20 0.42
TP53 P04637 1/20 0.41
SLC29A1 Q99808 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL19987158 0.91 NT5E (0.53) NT5E
SCHEMBL19987308 0.89 CYP3A4 (0.45) DNPH1CYP3A4CYP2C9
SCHEMBL21511201 0.89 CYP3A4 (0.45) DNPH1CYP3A4CYP2C9
SCHEMBL19987378 0.87 DNPH1 (0.44) DNPH1NT5EP2RX3P2RX2ADORA3
SCHEMBL19987319 0.87 CYP3A4 (0.42) DNPH1NT5EP2RX3P2RX2ADORA3
SCHEMBL19987311 0.87 CYP3A4 (0.46) DNPH1NT5EP2RX3P2RX2ADORA3
SCHEMBL19987170 0.86 NT5E (0.53) NT5EADORA3
SCHEMBL19987207 0.86 NT5E (0.52) NT5E
SCHEMBL19987168 0.85 NT5E (0.52) NT5E
SCHEMBL19987334 0.84 CYP3A4 (0.42) CYP3A4CYP2C9

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-20190322693-A1 NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF LCB PHARMA INC. (CA) 2019-10-24 US disclosed
WO-2018049535-A1 NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF LCB PHARMA INC. (CA) 2018-03-22 WO 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-20190322693-A1 NUCLEOSIDE ANALOGUES AND METHODS OF USE THEREOF PNP, TYMP, MTAP DNPH1 1314/4885NT5E 63/4885P2RX3 1254/4885

“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.