SCHEMBL5203556

SCHEMBL5203556

Cc1cccc2c1nc(CO)n2Cc1c(F)cccc1F

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.43
TNF P01375 1/20 0.41
TSHR P16473 1/20 0.41
TLR8 Q9NR97 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
PCSK9 Q8NBP7 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL5204108 0.88 TLR8 (0.40) PPARGTLR8MEN1KMT2AALDH1A1
SCHEMBL5203544 0.81 TLR8 (0.41) TLR8ALDH1A1SMN1; SMN2MAPTMAPK1
SCHEMBL5202601 0.78 NPY1R (0.38) PPARGTLR8ALDH1A1
SCHEMBL5201899 0.78 TLR8 (0.39) TSHRTLR8MEN1KMT2AALDH1A1
SCHEMBL5201251 0.77 TLR8 (0.39) PPARGTLR8MEN1KMT2AALDH1A1
SCHEMBL5201306 0.76 KCNK13 (0.45) TLR8MEN1KMT2AALDH1A1MAPT
SCHEMBL5207236 0.74 ALDH1A1 (0.40) PPARGTLR8KMT2AALDH1A1MAPT
SCHEMBL5201108 0.74 CYP11B2 (0.50) TP53
SCHEMBL5204661 0.74 GNRHR (0.41) PPARGTLR8ALDH1A1SMN1; SMN2MAPT
SCHEMBL5202670 0.73 TLR8 (0.39) PPARGTLR8MEN1KMT2AALDH1A1

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
EP-1210336-B1 SUBSTITUTED BENZIMIDAZOLES AS NON-NUCLEOSIDE INHIBITORS OF REVERSE TRANSCRIPTASE US HEALTH (US) 2007-04-25 EP disclosed
US-6894068-B2 Substituted benzimidazoles as non-nucleoside inhibitors of reverse transcriptase THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-05-17 US disclosed
US-20030191160-A1 Substituted benzimidazoles as non-nucleoside inhibitors of reverse transcriptase MICHEJDA CHRISTOPHER J (US) 2003-10-09 US disclosed
EP-0963371-B1 SUBSTITUTED BENZIMIDAZOLES AS NON-NUCLEOSIDE INHIBITORS OF REVERSE TRANSCRIPTASE US GOV HEALTH & HUMAN SERV (US) 2003-05-02 EP disclosed
US-6369235-B1 INHIBITORS OF HIV REVERSE TRANSCRIPTION FOR TREATMENT OF AIDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2002-04-09 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-20030191160-A1 Substituted benzimidazoles as non-nucleoside inhibitors of reverse transcriptase SAMHD1, DUT, TYMP PPARG 2885/4885TNF 3481/4885TSHR 4403/4885

“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.