SCHEMBL7561364

SCHEMBL7561364

CC(=NNC(=O)c1[nH]c2ccccc2c1C(C)C)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.52
KMT2A Q03164 6/20 0.52
MEN1 O00255 4/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GAA P10253 5/20 0.52
ALDH1A1 P00352 6/20 0.50
POLB P06746 2/20 0.50
CASP6 P55212 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPK1 P28482 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HTT P42858 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
ATM Q13315 1/20 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
SCHEMBL7561358 1.00 MAPT (0.52) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL7561090 0.85 MAPT (0.50) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL7529205 0.85 NPC1 (0.50) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL7558851 0.85 NPC1 (0.50) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL7561095 0.85 MAPT (0.50) MAPTKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL7559001 0.82 ALDH1A1 (0.53) MAPTKMT2AMEN1SMN1; SMN2GAA
SCHEMBL7559004 0.82 ALDH1A1 (0.53) MAPTKMT2AMEN1SMN1; SMN2GAA
SCHEMBL7676490 0.82 MEN1 (0.62) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL7676485 0.82 MEN1 (0.62) MAPTKMT2AMEN1LMNASMN1; SMN2
SCHEMBL7564275 0.76 RAB9A (0.60) MAPTKMT2AMEN1LMNASMN1; SMN2

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-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors ABBOTT LABORATORIES 2002-07-11 US claimed
WO-2002022576-A2 3-SUBSTITUTED INDOLE CARBOHYDRAZIDES USEFUL AS CELL PROLIFERATION AND ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2002-03-21 WO claimed
US-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors ABBOTT LABORATORIES 2002-07-11 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-20020091148-A1 3-substituted indole antiproliferative angiogenesis inhibitors MKI67, FLT4, IDO1 MAPT 4828/4885KMT2A 2765/4885MEN1 3165/4885

“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.