SCHEMBL19984632

SCHEMBL19984632

CC(C)(C)OC(=O)NC1CCC(Cc2ncc(CN)s2)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 7/20 0.42
▸ JAK1 P23458 4/20 0.40
▸ JAK2 O60674 3/20 0.40
▸ KDM1A O60341 2/20 0.39
▸ MAOB P27338 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ CKS1B P61024 1/20 0.39
▸ SKP1 P63208 1/20 0.39
▸ SKP2 Q13309 1/20 0.39
▸ SMYD3 Q9H7B4 1/20 0.39
▸ PBK Q96KB5 1/20 0.38
▸ BTK Q06187 2/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ JAK3 P52333 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
SCHEMBL19984626 0.90 DRD2 (0.43) DRD2JAK1JAK2KDM1AMAOB
SCHEMBL19984621 0.89 DRD2 (0.42) DRD2JAK1JAK2KDM1AMAOB
SCHEMBL19984631 0.86 DRD2 (0.40) DRD2JAK1JAK2KDM1AMAOB
SCHEMBL19984627 0.83 DRD2 (0.39) DRD2JAK1JAK2KDM1AMAOB
SCHEMBL18667341 0.83 KCNA3 (0.45) DRD2CKS1BSKP1SKP2
SCHEMBL24645671 0.76 PDPK1 (0.46) —
SCHEMBL24011305 0.75 DRD2 (0.50) DRD2JAK1JAK2KDM1AMAOB
SCHEMBL352832 0.73 DRD2 (0.49) DRD2KDM1AMAOBDRD3BTK
SCHEMBL3943582 0.73 DRD2 (0.49) DRD2KDM1AMAOBDRD3BTK
SCHEMBL352831 0.73 DRD2 (0.49) DRD2KDM1AMAOBDRD3BTK

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
CN-109937201-A HEPATITIS B CORE PROTEIN MODULATORS 组装生物科学股份有限公司 2019-06-25 — — CN 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 DRD2 4597/4885JAK1 2998/4885JAK2 2041/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS DRD2 4597/4885JAK1 2998/4885JAK2 2041/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS DRD2 4597/4885JAK1 2998/4885JAK2 2041/4885

“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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