SCHEMBL21626410

SCHEMBL21626410

O=C(Nc1ccc(F)cc1Cl)c1ccc(F)c(S(=O)(=O)Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.49
▸ TP53 P04637 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALOX15 P16050 7/20 0.49
▸ KMT2A Q03164 2/20 0.48
▸ HDAC1 Q13547 1/20 0.48
▸ PYGL P06737 1/20 0.46
▸ ATM Q13315 1/20 0.45
▸ KCNMA1 Q12791 1/20 0.45

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
SCHEMBL21623148 0.83 POLB (0.52) MAPTTP53LMNAKDM4EKMT2A
SCHEMBL21623221 0.81 NPC1 (0.51) MAPTTP53LMNAKDM4EKMT2A
SCHEMBL21623104 0.80 HDAC1 (0.52) MAPTALOX15KMT2AHDAC1PYGL
SCHEMBL15076561 0.79 NPC1 (0.62) MAPTTP53LMNAKDM4EKMT2A
SCHEMBL15076544 0.76 LMNA (0.61) MAPTTP53LMNAKMT2A
SCHEMBL15076530 0.76 MAPT (0.54) MAPTTP53LMNAKMT2A
SCHEMBL94124 0.75 HDAC1 (0.55) MAPTKDM4EALOX15KMT2AHDAC1
SCHEMBL21623273 0.75 KCNQ3 (0.73) —
SCHEMBL21623303 0.74 MAPT (0.52) MAPTTP53LMNAKMT2A
SCHEMBL18147885 0.73 SMN1; SMN2 (0.78) MAPTTP53KDM4EALOX15KMT2A

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-20210276967-A1 INHIBITORS OF HEPATITIS B VIRUS OSPEDALE SAN RAFFAELE S.R.L. (IT) 2021-09-09 — — US disclosed
WO-2020016434-A1 CYCLIC INHIBITORS OF HEPATITIS B VIRUS OSPEDALE SAN RAFFAELE S.R.L. (IT) 2020-01-23 — — WO disclosed
WO-2020016427-A1 INHIBITORS OF HEPATITIS B VIRUS OSPEDALE SAN RAFFAELE S.R.L. (IT) 2020-01-23 — — WO disclosed
EP-3597637-A1 INHIBITORS OF HEPATITIS B VIRUS IRBM S.P.A. (IT) 2020-01-22 — — EP disclosed
EP-3597653-A1 CYCLIC INHIBITORS OF HEPATITIS B VIRUS IRBM S.P.A. (IT) 2020-01-22 — — EP 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 (1 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-20210276967-A1 INHIBITORS OF HEPATITIS B VIRUS HAVCR2, SLC10A1, HDGF MAPT 3587/4885TP53 979/4885LMNA 2017/4885

“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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