SCHEMBL10028049

SCHEMBL10028049

Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.66
ALDH1A1 P00352 5/20 0.66
KMT2A Q03164 4/20 0.66
MEN1 O00255 3/20 0.66
POLB P06746 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.53
RAB9A P51151 2/20 0.53
MAPK1 P28482 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HSD17B10 Q99714 1/20 0.50
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
PKM P14618 1/20 0.47
DUSP3 P51452 1/20 0.47
BLM P54132 1/20 0.47
PTPN5 P54829 1/20 0.47
PTPN11 Q06124 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
TDP1 Q9NUW8 2/20 0.44

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
SCHEMBL3362738 0.89 MAPT (0.75) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL13809595 0.82 MAPT (0.63) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL14267957 0.80 MAPT (0.64) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL16029701 0.79 MAPT (1.00) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL14363096 0.79 ALDH1A1 (0.51) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL3063864 0.78 MAPT (0.65) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL21067641 0.78 MAPT (0.65) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL10405791 0.78 HSD17B10 (0.72) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL3363633 0.76 ALDH1A1 (0.58) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL15996807 0.75 MAPT (0.50) MAPTALDH1A1KMT2AMEN1POLB

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-20120010259-A1 Methods of Treating an Overweight or Obese Subject ZAFGEN, INC. 2012-01-12 US disclosed
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS BONFANTI JEAN-FRANCOIS 2009-09-03 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 (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-20120010259-A1 Methods of Treating an Overweight or Obese Subject METAP2, METAP1, ACER2 MAPT 3100/4885ALDH1A1 802/4885KMT2A 444/4885
US-20090221559-A1 BENZODIAZEPINES AS HCV INHIBITORS GABRA5, GABRA4, GABRA3 MAPT 1578/4885ALDH1A1 372/4885KMT2A 1440/4885

“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.