SCHEMBL17465680

SCHEMBL17465680

CC1(NS(=O)(=O)c2ccc(F)c(C(=O)Nc3cc(F)c(F)c(F)c3)c2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 14/20 0.50
▸ MAPT P10636 9/20 0.50
▸ POLB P06746 3/20 0.50
▸ LMNA P02545 9/20 0.49
▸ KDM4E B2RXH2 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ USP2 O75604 1/20 0.45
▸ ALDH1A1 P00352 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
SCHEMBL15848086 0.91 MAPT (0.61) TP53MAPTPOLBLMNAKDM4E
SCHEMBL15847752 0.86 MAPT (0.62) TP53MAPTPOLBLMNA
SCHEMBL15847804 0.84 TP53 (0.48) TP53MAPTPOLBLMNAKDM4E
SCHEMBL17465669 0.82 TP53 (0.49) TP53MAPTPOLBLMNA
SCHEMBL25404240 0.81 PARG (0.50) LMNAUSP2ALDH1A1
SCHEMBL25404892 0.81 PARG (0.50) USP2
SCHEMBL15848014 0.81 MAPT (0.58) TP53MAPTPOLBLMNAKDM4E
SCHEMBL26688687 0.80 ALDH1A1 (0.53) USP2ALDH1A1
SCHEMBL18948563 0.78 TP53 (0.51) TP53MAPTPOLBLMNAKDM4E
SCHEMBL15076500 0.77 MAPT (0.52) TP53MAPTPOLBLMNAKDM4E

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-9938236-B2 Antiviral agents against HBV infection DREXEL UNIVERSITY (US) 2018-04-10 — — US disclosed
US-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-01-28 — — 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 (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-20160024004-A1 NOVEL ANTIVIRAL AGENTS AGAINST HBV INFECTION HAVCR2, EIF2AK2, NR1H4 TP53 3039/4885MAPT 4494/4885POLB 135/4885

“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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