SCHEMBL18153335

SCHEMBL18153335

O=c1oc2ccccc2c([N+](=O)[O-])c1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.59
ALDH1A1 P00352 8/20 0.56
HTT P42858 3/20 0.56
PKM P14618 1/20 0.56
MAPT P10636 10/20 0.55
GPR55 Q9Y2T6 1/20 0.52
HPGD P15428 1/20 0.52
GAA P10253 3/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.48
CA1 P00915 1/20 0.46
CA2 P00918 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
SCHEMBL3680354 0.81 LMNA (0.62) LMNAALDH1A1HTTPKMMAPT
SCHEMBL11531290 0.79 LMNA (0.51) LMNAALDH1A1HTTPKMMAPT
SCHEMBL1800595 0.78 CA1 (0.56) LMNAALDH1A1PKMMAPTHPGD
SCHEMBL3680356 0.78 LMNA (0.67) LMNAALDH1A1HTTPKMMAPT
SCHEMBL17915420 0.76 S100A4 (0.57) LMNAALDH1A1HTTPKMMAPT
SCHEMBL7274704 0.76 MAPT (0.46) LMNAALDH1A1HTTPKMMAPT
SCHEMBL1457741 0.75 LMNA (0.58) LMNAALDH1A1HTTPKMMAPT
SCHEMBL12490543 0.75 CA1 (0.58) LMNAALDH1A1HTTPKMMAPT
SCHEMBL28007961 0.75 NQO1 (0.61) LMNAALDH1A1HTTPKMMAPT
SCHEMBL2017838 0.74 LMNA (0.67) LMNAALDH1A1HTTPKMMAPT

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-10718028-B2 Fluorescent probes for abasic site detection CASE WESTERN RESERVE UNIVERSITY (US) 2020-07-21 US disclosed
US-20180127830-A1 FLUORESCENT PROBES FOR ABASIC SITE DETECTION CASE WESTERN RESERVE UNIVERSITY 2018-05-10 US disclosed
WO-2016168467-A2 FLUORESCENT PROBES FOR ABASIC SITE DETECTION CASE WESTERN RESERVE UNIVERSITY (US) 2016-10-20 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 (2 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-10718028-B2 Fluorescent probes for abasic site detection OGG1, UNG, AP2B1 LMNA 354/4885ALDH1A1 3035/4885HTT 4083/4885
US-20180127830-A1 FLUORESCENT PROBES FOR ABASIC SITE DETECTION OGG1, UNG, AP2B1 LMNA 354/4885ALDH1A1 3035/4885HTT 4083/4885

“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.