SCHEMBL999490

SCHEMBL999490

Cc1ccc([N+](=O)[O-])c(C(=O)NN)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.61
TSHR P16473 2/20 0.53
CYP3A4 P08684 1/20 0.53
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 1/20 0.48
POLB P06746 1/20 0.48
KCNMA1 Q12791 1/20 0.47
KAT2B Q92831 1/20 0.47
HPGD P15428 1/20 0.46

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
SCHEMBL491747 0.81 TSHR (0.58) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL688229 0.81 TSHR (0.58) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL30440428 0.81 TSHR (0.58) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL28395903 0.81 TSHR (0.62) TSHRCYP3A4MAPTALDH1A1SLC6A2
SCHEMBL19554297 0.81 ALDH1A1 (0.65) CTSDTSHRCYP3A4MAPTALDH1A1
SCHEMBL1277039 0.80 TSHR (0.60) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL149316 0.80 DTYMK (0.62) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL29935450 0.80 DTYMK (0.62) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL145815 0.79 SIRT6 (0.57) TSHRCYP3A4MAPTALDH1A1POLB
SCHEMBL13657380 0.79 TSHR (0.55) TSHRCYP3A4MAPTALDH1A1POLB

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-7867980-B2 Lincosamide derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-11 US disclosed
US-20100184746-A1 LINCOSAMIDE DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD 2010-07-22 US disclosed
EP-2166015-A1 LINCOSAMIDE DERIVATIVE, AND ANTIBACTERIAL AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT Meiji Seika Kaisha Ltd. (JP) 2010-03-24 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-20100184746-A1 LINCOSAMIDE DERIVATIVES AND ANTIMICROBIAL AGENTS COMPRISING THE SAME AS ACTIVE INGREDIENT SIRT6, LAS1L, MRPS18A CTSD 979/4885TSHR 1317/4885CYP3A4 2743/4885

“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.