SCHEMBL30429807

SCHEMBL30429807

CC(C)OC(=O)[C@H](C)NP(=O)(Oc1ccccc1)Oc1ccc([N+](=O)[O-])cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.45
▸ MAPT P10636 8/20 0.45
▸ LMNA P02545 6/20 0.45
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ MEN1 O00255 7/20 0.45
▸ KMT2A Q03164 7/20 0.45
▸ HSP90AA1 P07900 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ BTN3A1 O00481 3/20 0.43
▸ PKM P14618 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ TP53 P04637 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ NFKB1 P19838 1/20 0.41
▸ MAPK1 P28482 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
SCHEMBL2512291 1.00 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL2516894 1.00 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL2551776 1.00 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL2551777 1.00 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL2512295 1.00 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL17972437 1.00 ALDH1A1 (0.45) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL17972438 0.94 MAPT (0.50) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL28938599 0.90 ALDH1A1 (0.48) ALDH1A1MAPTLMNASMN1; SMN2MEN1
SCHEMBL2510985 0.89 MEN1 (0.44) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL2510987 0.89 MEN1 (0.44) ALDH1A1MAPTLMNAMEN1KMT2A

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
US-12595280-B2 Phosphoramidates for the treatment of hepatitis B virus EMORY UNIVERSITY (US) 2026-04-07 — — US disclosed
US-20240309039-A1 PHOSPHORAMIDATES FOR THE TREATMENT OF HEPATITIS B VIRUS EMORY UNIVERSITY 2024-09-19 — — US disclosed
WO-2023044104-A1 PHOSPHORAMIDATES FOR THE TREATMENT OF HEPATITIS B VIRUS EMORY UNIVERSITY (US) 2023-03-23 — — 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 (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-12595280-B2 Phosphoramidates for the treatment of hepatitis B virus SLC10A1, BCL9L, OAT ALDH1A1 3492/4885MAPT 3615/4885LMNA 2383/4885
US-20240309039-A1 PHOSPHORAMIDATES FOR THE TREATMENT OF HEPATITIS B VIRUS TYMP, PNP, MTAP ALDH1A1 3093/4885MAPT 1611/4885LMNA 2289/4885

“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.

Send feedback