SCHEMBL22577418

SCHEMBL22577418

CCCCCCCCCCCCCCCCOC(CC)[PH](=S)COC(C)Cn1cnc2c(N)ncnc21

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 15/20 0.60
▸ CYP2D6 P10635 14/20 0.60
▸ ADORA2A P29274 2/20 0.47
▸ ADORA1 P30542 1/20 0.46

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
SCHEMBL22577407 0.89 CYP3A4 (0.62) CYP3A4CYP2D6ADORA2A
SCHEMBL22577416 0.83 CYP3A4 (0.62) CYP3A4CYP2D6
SCHEMBL22577403 0.80 CYP3A4 (0.65) CYP3A4CYP2D6
SCHEMBL29211967 0.79 CYP3A4 (0.67) CYP3A4CYP2D6ADORA2AADORA1
SCHEMBL29211966 0.79 CYP3A4 (0.67) CYP3A4CYP2D6ADORA2AADORA1
SCHEMBL30931874 0.79 CYP3A4 (0.67) CYP3A4CYP2D6ADORA2AADORA1
SCHEMBL30931891 0.79 CYP3A4 (0.67) CYP3A4CYP2D6ADORA2AADORA1
Ammonia Solution, Strong SCHEMBL29626970 0.77 CYP3A4 (0.65) CYP3A4CYP2D6
Ammonia Solution, Strong SCHEMBL29626966 0.77 CYP3A4 (0.65) CYP3A4CYP2D6
SCHEMBL22577390 0.76 CYP3A4 (0.57) CYP3A4CYP2D6ADORA2AADORA1

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
EP-3730503-B1 ANTIVIRAL NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR SHENZHEN TARGETRX INC (CN) 2026-01-28 — — EP disclosed
US-20220389038-A1 ANTIVIRAL NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR SHENZHEN TARGETRX, INC. (CN) 2022-12-08 — — US disclosed
US-11447512-B2 Antiviral nucleoside reverse transcriptase inhibitor SHENZHEN TARGETRX, INC. (CN) 2022-09-20 — — US disclosed
US-20200369696-A1 ANTIVIRAL NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR SHENZHEN TARGETRX, INC. (CN) 2020-11-26 — — US disclosed
EP-3730503-A1 ANTIVIRAL NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR Shenzhen TargetRx, Inc. (CN) 2020-10-28 — — EP 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 (3 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-20200369696-A1 ANTIVIRAL NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR TYMP, HPRT1, POLRMT CYP3A4 381/4885CYP2D6 293/4885ADORA2A 3606/4885
US-11447512-B2 Antiviral nucleoside reverse transcriptase inhibitor TYMP, HPRT1, POLRMT CYP3A4 381/4885CYP2D6 293/4885ADORA2A 3606/4885
US-20220389038-A1 ANTIVIRAL NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR TYMP, HPRT1, POLRMT CYP3A4 381/4885CYP2D6 293/4885ADORA2A 3606/4885

“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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