SCHEMBL21291406

SCHEMBL21291406

COC(=O)c1ccc(Sc2ccccc2C(=O)OC)cc1S

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
HSD17B10 Q99714 2/20 0.48
POLB P06746 2/20 0.48
PKLR P30613 1/20 0.46
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
CRBN Q96SW2 1/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 2/20 0.41
CFTR P13569 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL930179 0.80 ALDH1A1 (0.53) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL5887723 0.80 SIRT1 (0.61) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL4440485 0.79 HSD17B10 (0.64) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL6934406 0.79 HSD17B10 (0.53) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL14176672 0.79 MAPT (0.56) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL28861488 0.79 MAPT (0.47) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL6934243 0.78 SMN1; SMN2 (0.50) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL9323438 0.78 HSD17B10 (0.48) MAPTHSD17B10POLBTSHRLMNA
SCHEMBL4802025 0.78 MAPT (0.55) MAPTHSD17B10POLBPKLRTSHR
SCHEMBL12772114 0.75 ALDH1A1 (0.51) MAPTHSD17B10POLBPKLRTSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 MAPT 3090/4885HSD17B10 1394/4885POLB 1770/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS MAPT 3090/4885HSD17B10 1394/4885POLB 1770/4885

“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.