SCHEMBL31714780

SCHEMBL31714780

CCOC(=O)c1c(N)nc2n1CCOC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
ALDH1A1 P00352 6/20 0.41
LMNA P02545 1/20 0.41
PIK3CA P42336 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 5/20 0.40
HPGD P15428 4/20 0.40
HSD17B10 Q99714 3/20 0.40
GAA P10253 2/20 0.40
TSHR P16473 2/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
TP53 P04637 2/20 0.39
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
CASP7 P55210 1/20 0.37
CASP6 P55212 1/20 0.37

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
SCHEMBL31714775 0.80 POLB (0.67) POLBALDH1A1LMNAKDM4EHPGD
SCHEMBL3738019 0.78 POLB (0.62) POLBALDH1A1LMNAKDM4EHPGD
SCHEMBL4038454 0.74 MAPT (0.41) POLBALDH1A1PIK3CAL3MBTL1KDM4E
SCHEMBL17454164 0.74 DPP4 (0.41) POLBALDH1A1LMNAPIK3CAL3MBTL1
SCHEMBL14800123 0.73 TP53 (0.62) POLBLMNAHSD17B10TSHRMAPT
SCHEMBL20360337 0.72 PIK3CA (0.43) ALDH1A1LMNAPIK3CAL3MBTL1KDM4E
SCHEMBL25523006 0.70 LMNA (0.46) POLBALDH1A1LMNAKDM4EHPGD
SCHEMBL13959068 0.69 GAA (0.42) POLBALDH1A1PIK3CAL3MBTL1KDM4E
SCHEMBL3228644 0.64 KMT2A (0.45) POLBALDH1A1LMNAKDM4EHPGD
SCHEMBL10846139 0.64 KMT2A (0.45) POLBALDH1A1LMNAKDM4EHPGD

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
US-20250333424-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2025-10-30 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-20250333424-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, IRF3 POLB 137/4885ALDH1A1 3515/4885LMNA 3393/4885

“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.