SCHEMBL7124297

SCHEMBL7124297

Nc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)sc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.61
MMP13 P45452 1/20 0.61
MAPT P10636 6/20 0.60
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
CACNA1B Q00975 1/20 0.60
APBA1 Q02410 1/20 0.60
MCL1 Q07820 1/20 0.59
SMN1; SMN2 Q16637 5/20 0.57
ALDH1A1 P00352 4/20 0.57
LMNA P02545 3/20 0.57
CXCR2 P25025 1/20 0.57
RXFP1 Q9HBX9 1/20 0.56
KMT2A Q03164 4/20 0.55
MEN1 O00255 2/20 0.54
RORC P51449 1/20 0.54
POLB P06746 1/20 0.53
STAT1 P42224 1/20 0.53
ACP1 P24666 1/20 0.53
ALOX12 P18054 1/20 0.53

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
SCHEMBL7129461 0.93 DYRK1A (0.70) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7127487 0.90 MMP13 (0.74) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7162058 0.88 DYRK1A (0.64) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7119606 0.88 MAPT (0.61) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7125923 0.88 DYRK1A (0.57) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL5731624 0.87 MAPT (0.69) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7123602 0.87 DYRK1A (0.67) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7127519 0.86 SCD (0.73) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7129459 0.83 MAPT (0.55) DYRK1AMMP13MAPTNPC1RAB9A
SCHEMBL7125975 0.82 MAPT (0.62) DYRK1AMMP13MAPTNPC1RAB9A

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
CN-1440383-A PPAR gamma modulators SANKYO CO (JP) 2003-09-03 CN disclosed
US-20030134859-A1 PPAR-gamma modulator SANKYO COMPANY, LIMITED (JP) 2003-07-17 US disclosed
EP-1277729-A1 PPAR (GAMMA) MODULATORS Sankyo Company, Limited (JP) 2003-01-22 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-20030134859-A1 PPAR-gamma modulator PPARG, PPARA, PPARD DYRK1A 3783/4885MMP13 2283/4885MAPT 4391/4885

“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.