SCHEMBL10102006

SCHEMBL10102006

Cc1c(Br)nc(N(C)C)c(OCc2ccccc2)c1C(=O)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.40
MAPT P10636 5/20 0.37
HPGD P15428 2/20 0.37
ALOX5 P09917 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
NOX1 Q9Y5S8 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAOB P27338 1/20 0.35
EGFR P00533 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
SCHEMBL10102002 0.91 PTPN1 (0.40) PTPN1MAPTHPGDALOX5LMNA
SCHEMBL10101766 0.88 PTPN1 (0.43) PTPN1MAPTHPGDLMNATP53
SCHEMBL10102086 0.86 PTPN1 (0.43) PTPN1MAPTHPGDLMNATP53
SCHEMBL10107487 0.86 MAPT (0.39) MAPTLMNAALDH1A1
SCHEMBL10102212 0.85 PTPN1 (0.42) PTPN1MAPTHPGDLMNATP53
SCHEMBL10102147 0.84 PTPN1 (0.41) PTPN1MAPTHPGDALOX5LMNA
SCHEMBL10102072 0.84 PTPN1 (0.41) PTPN1MAPTHPGDLMNATP53
SCHEMBL10101768 0.82 PTPN1 (0.41) PTPN1MAPTHPGDLMNATP53
SCHEMBL10102066 0.80 PTPN1 (0.41) PTPN1MAPTHPGDLMNATP53
SCHEMBL10102077 0.80 PTPN1 (0.41) PTPN1MAPTHPGDLMNATP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8828988-B2 8-AZA tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2014-09-09 US disclosed
US-8367654-B2 8-AZA tetracycline compounds TETRAPHASE PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-20120108569-A1 8-AZA Tetracycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-03 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-20120108569-A1 8-AZA Tetracycline Compounds TET1, TET3, HDAC8 PTPN1 508/4885MAPT 921/4885HPGD 2983/4885

“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.