SCHEMBL26545741

SCHEMBL26545741

CC(C)c1ccc2c(NC(=O)CCOP(=O)(O)O)ncnn12

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EGLN2 Q96KS0 1/20 0.34
▸ TSHR P16473 1/20 0.31
▸ P2RY1 P47900 1/20 0.30
▸ RIPK1 Q13546 1/20 0.30
▸ TTK P33981 1/20 0.30
▸ GRM5 P41594 1/20 0.30
▸ SLC16A3 O15427 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
SCHEMBL26545438 0.93 EGLN2 (0.34) EGLN2TSHRRIPK1
SCHEMBL26200118 0.86 EGFR (0.41) EGLN2TSHR
SCHEMBL26545444 0.83 TSHR (0.44) TSHR
SCHEMBL26209285 0.83 EGLN2 (0.34) EGLN2TSHR
SCHEMBL26545442 0.80 HTT (0.42) TSHR
SCHEMBL26545440 0.79 DEGS1 (0.42) —
SCHEMBL26206054 0.78 EGFR (0.41) EGLN2TSHR
SCHEMBL26229442 0.76 PKM (0.36) EGLN2TSHRGRM5
SCHEMBL26229443 0.75 TSHR (0.44) TSHRGRM5
SCHEMBL26229441 0.74 MEN1 (0.38) TSHR

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-20230322813-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS GILEAD SCIENCES, INC. 2023-10-12 — — 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-20230322813-A1 COMPOUNDS AND METHODS FOR TREATMENT OF VIRAL INFECTIONS HAVCR2, EIF2AK2, OAT EGLN2 771/4885TSHR 4522/4885P2RY1 3105/4885

“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.

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