SCHEMBL19975387

SCHEMBL19975387

NCc1cnc(CC2CCC(OC(N)=O)CC2)s1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLS O94925 1/20 0.33
▸ SLC8A1 P32418 1/20 0.32
▸ SMYD3 Q9H7B4 1/20 0.32
▸ CYP19A1 P11511 1/20 0.30
▸ HRH3 Q9Y5N1 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL19975014 0.90 HRH3 (0.39) GLSCYP19A1HRH3SMN1; SMN2
SCHEMBL19975175 0.88 GLS (0.32) GLS
SCHEMBL19975142 0.82 ATM (0.30) —
SCHEMBL19975166 0.82 — —
SCHEMBL18641526 0.80 ALDH1A1 (0.36) HRH3SMN1; SMN2
SCHEMBL15896554 0.70 TRPA1 (0.33) GLSHRH3
SCHEMBL29934123 0.69 GSK3B (0.39) GLSSLC8A1HRH3
SCHEMBL18641468 0.69 HRH3 (0.44) HRH3SMN1; SMN2
SCHEMBL17525142 0.69 F2 (0.43) SMN1; SMN2
SCHEMBL28563135 0.68 PLG (0.48) CYP19A1

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-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2022-01-27 — — US disclosed
US-10987360-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2021-04-27 — — US disclosed
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2019-08-22 — — US disclosed
EP-3512845-A1 HEPATITIS B CORE PROTEIN MODULATORS Assembly Biosciences, Inc. (US) 2019-07-24 — — EP disclosed
WO-2018053157-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES, INC. (US) 2018-03-22 — — 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 (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-10987360-B2 Hepatitis B core protein modulators HAVCR2, FABP1, MAVS GLS 1656/4885SLC8A1 4789/4885SMYD3 3753/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS GLS 1656/4885SLC8A1 4789/4885SMYD3 3753/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS GLS 1656/4885SLC8A1 4789/4885SMYD3 3753/4885

“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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