SCHEMBL8060211

SCHEMBL8060211

Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 5/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
WDR5 P61964 3/20 0.56
MAPT P10636 7/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
LMNA P02545 3/20 0.54
NPSR1 Q6W5P4 1/20 0.54
HPGD P15428 1/20 0.54
RORC P51449 2/20 0.53
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL8059547 0.87 HTT (0.58) HTTSMN1; SMN2WDR5MAPTKMT2A
SCHEMBL10224066 0.87 KMT2A (0.56) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL10224183 0.84 RORC (0.57) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL18585560 0.83 HTT (0.56) HTTSMN1; SMN2WDR5MAPTKMT2A
SCHEMBL28581602 0.81 WDR5 (0.62) HTTSMN1; SMN2WDR5MAPTKMT2A
SCHEMBL25394799 0.80 KMT2A (0.56) HTTSMN1; SMN2WDR5MAPTKMT2A
SCHEMBL8218036 0.80 MAPT (0.55) SMN1; SMN2MAPTKMT2AALDH1A1MEN1
SCHEMBL19148638 0.79 MAPT (0.64) HTTSMN1; SMN2WDR5MAPTKMT2A
SCHEMBL29074265 0.78 KMT2A (0.64) HTTWDR5MAPTKMT2AALDH1A1
SCHEMBL16441779 0.78 MEN1 (0.69) HTTSMN1; SMN2MAPTKMT2AALDH1A1

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-20110183889-A1 SALICYLANILIDE MODIFIED PEPTIDES FOR USE AS ORAL THERAPEUTICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-07-28 US disclosed
WO-2009032749-A2 SALICYLANILIDE MODIFIED PEPTIDES FOR USE AS ORAL THERAPEUTICS THE REGENTS OF THE UNIVERSITY OF CALIFORNINA (US) 2009-03-12 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 (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-20110183889-A1 SALICYLANILIDE MODIFIED PEPTIDES FOR USE AS ORAL THERAPEUTICS DNPEP, PTMS, NGLY1 HTT 1204/4885SMN1; SMN2 1291/4885WDR5 1573/4885

“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.