SCHEMBL19975069

SCHEMBL19975069

COS(=O)(=O)Cc1cnn(-c2nccs2)c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
PPARG P37231 1/20 0.35
MAPK10 P53779 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
SCN9A Q15858 2/20 0.34
TDP1 Q9NUW8 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
RECQL P46063 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL19975070 0.75 CA12 (0.36) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL19975267 0.74 PDE10A (0.34) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL24221966 0.74 GABRA1 (0.42) ALDH1A1PPARGMAPK10KMT2ANPSR1
Hydrochloric Acid SCHEMBL19975461 0.73 GABRA1 (0.41) ALDH1A1TDP1
SCHEMBL2529820 0.72 FFAR4 (0.39) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL31517219 0.72 ALDH1A1 (0.39) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL31517602 0.71 ALDH1A1 (0.34) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL16547534 0.69 TDO2 (0.39) ALDH1A1PPARGMAPK10KMT2ANPSR1
SCHEMBL28230000 0.68 KDM4A (0.38) SCN9A
SCHEMBL19975093 0.68 KDM4E (0.33) ALDH1A1

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 ALDH1A1 3992/4885PPARG 604/4885MAPK10 1586/4885
US-20190255067-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS ALDH1A1 3992/4885PPARG 604/4885MAPK10 1586/4885
US-20220023311-A1 HEPATITIS B CORE PROTEIN MODULATORS HAVCR2, FABP1, MAVS ALDH1A1 3992/4885PPARG 604/4885MAPK10 1586/4885

“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.