SCHEMBL19984498

SCHEMBL19984498

COC(=O)c1ccc2c(c1C)NC(=O)c1ccncc1S2(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GLA P06280 2/20 0.39
GAA P10253 2/20 0.39
CYP46A1 Q9Y6A2 1/20 0.36
FGFR1 P11362 1/20 0.35
SRC P12931 1/20 0.35
FGFR2 P21802 1/20 0.35
FGFR4 P22455 1/20 0.35
FGFR3 P22607 1/20 0.35
CHEK1 O14757 1/20 0.34
PARP1 P09874 1/20 0.34
CSNK2A1 P68400 1/20 0.34
CCNC P24863 2/20 0.34
CDK8 P49336 2/20 0.34
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC40A1 Q9NP59 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32

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
SCHEMBL19984503 0.87 KDM4C (0.37) ALDH1A1KDM4ECSNK2A1CCNCCDK8
SCHEMBL18666974 0.83 CHEK1 (0.44) ALDH1A1CHEK1SLC40A1PKLRROCK2
SCHEMBL19984515 0.80 TP53 (0.33) ALDH1A1CCNCCDK8
SCHEMBL19984499 0.80 KDM4E (0.39) ALDH1A1KDM4EGLAGAACYP46A1
SCHEMBL2921667 0.69 CES1 (0.53) KDM4EGLAGAACYP46A1CHEK1
SCHEMBL18666975 0.67 TP53 (0.49) ALDH1A1KDM4EGAACHEK1LMNA
SCHEMBL19984564 0.66 KDM4C (0.37) ALDH1A1KDM4EGAACSNK2A1CCNC
SCHEMBL19984495 0.65 TLK2 (0.40) CHEK1PARP1CSNK2A1SLC40A1ROCK2
SCHEMBL1440123 0.65 SIRT3 (0.61) ALDH1A1KDM4EGLAGAACYP46A1
SCHEMBL30957166 0.65 SIRT3 (0.61) ALDH1A1KDM4EGLAGAACYP46A1

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 6 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-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 ALDH1A1 3992/4885KDM4E 2469/4885GLA 3987/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS ALDH1A1 3992/4885KDM4E 2469/4885GLA 3987/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS ALDH1A1 3992/4885KDM4E 2469/4885GLA 3987/4885

“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.