SCHEMBL19984495

SCHEMBL19984495

O=C(O)c1ccc2c(c1)NC(=O)c1ccncc1S2(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLK2 Q86UE8 3/20 0.40
CA12 O43570 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CHEK1 O14757 1/20 0.40
PARP1 P09874 1/20 0.40
CSNK2A1 P68400 1/20 0.40
BACE1 P56817 3/20 0.39
TDP2 O95551 1/20 0.38
HTT P42858 1/20 0.37
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CDC7 O00311 2/20 0.35
ROCK2 O75116 2/20 0.35
MAP4K4 O95819 2/20 0.35
PRKACA P17612 2/20 0.35
CDK2 P24941 2/20 0.35
GSK3B P49841 2/20 0.35

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
SCHEMBL15896222 0.81 CHEK1 (0.61) CA12CA2CA4CA7CA9
SCHEMBL19984493 0.77 HPGD (0.49) TLK2PARP1CSNK2A1BACE1HTT
SCHEMBL11394501 0.73 CHEK1 (0.65) CA12CA2CA4CA7CA9
SCHEMBL21273277 0.73 CA12 (0.43) TLK2CA12CA2CA4CA7
SCHEMBL21291402 0.73 ROCK2 (0.38) BACE1POLBROCK2
SCHEMBL18667034 0.72 CHEK1 (0.41) TLK2CA12CA2CA4CA7
SCHEMBL30271181 0.72 CHEK1 (0.41) TLK2CA12CA2CA4CA7
SCHEMBL19984503 0.72 KDM4C (0.37) CA12CA2CA4CA7CA9
SCHEMBL17085929 0.72 SMN1; SMN2 (0.69) BACE1POLBSMN1; SMN2
SCHEMBL23346244 0.71 TTR (0.46) TLK2CA12CA2CA4CA7

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 7 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-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-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
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS ASSEMBLY BIOSCIENCES INC (US) 2019-08-22 US 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 TLK2 3619/4885CA12 3579/4885CA2 4713/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS TLK2 3619/4885CA12 3579/4885CA2 4713/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS TLK2 3619/4885CA12 3579/4885CA2 4713/4885

“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.