SCHEMBL3373498

SCHEMBL3373498

Cc1ccc(Sc2nc(N)nc3c2ncn3CC2(OC(OC3(Cn4cnc5c(Sc6ccc(C)cc6)nc(N)nc54)CC3CC(F)(F)F)P(=O)(O)O)CC2CC(F)(F)F)cc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.32
HK1 P19367 1/20 0.32
HKDC1 Q2TB90 1/20 0.32
SLC29A1 Q99808 1/20 0.31
CYP1A2 P05177 1/20 0.30
PNP P00491 1/20 0.30

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
SCHEMBL2912855 0.80 CYP2C19 (0.35) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL3375933 0.79 POLB (0.49)
SCHEMBL2914175 0.76 CYP2C19 (0.34) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL2910504 0.75 CYP2C19 (0.37) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL2908457 0.74 CYP2C19 (0.37) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL5669549 0.73 CYP2C19 (0.35) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL5669560 0.73 CYP2C19 (0.35) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL3290187 0.73 HSP90AA1 (0.33) CYP2C19HK1HKDC1CYP1A2PNP
SCHEMBL2991768 0.73 ADORA2A (0.34) CYP2C19HK1HKDC1SLC29A1CYP1A2
SCHEMBL2991772 0.72 ADORA2A (0.35) CYP2C19HK1HKDC1SLC29A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723319-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2010-05-25 US disclosed
US-7605147-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2009-10-20 US disclosed
US-7157448-B2 Acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2007-01-02 US disclosed
US-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same CHO DONG-GYU 2006-12-28 US disclosed
US-20040063668-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same LG LIFE SCIENCES LTD. (KR) 2004-04-01 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 (2 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-20060293284-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP CYP2C19 681/4885HK1 1106/4885HKDC1 1842/4885
US-20040063668-A1 Novel acyclic nucleoside phosphonate derivatives, salts thereof and process for the preparation of the same PNP, ITPA, MTAP CYP2C19 681/4885HK1 1106/4885HKDC1 1842/4885

“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.