SCHEMBL7127519

SCHEMBL7127519

COc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)sc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 4/20 0.73
RAB9A P51151 10/20 0.69
KMT2A Q03164 7/20 0.69
MEN1 O00255 6/20 0.69
NPC1 O15118 9/20 0.61
POLB P06746 1/20 0.61
CASP3 P42574 1/20 0.61
SENP8 Q96LD8 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
SENP6 Q9GZR1 1/20 0.61
TP53 P04637 3/20 0.61
MAPT P10636 3/20 0.61
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.60
DYRK1A Q13627 2/20 0.60
KDM4E B2RXH2 2/20 0.60
HPGD P15428 2/20 0.60
PKM P14618 1/20 0.60
NFKB1 P19838 1/20 0.60

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
SCHEMBL4916716 0.92 SCD (0.73) SCDRAB9AKMT2AMEN1NPC1
SCHEMBL7129461 0.90 DYRK1A (0.70) SCDRAB9AKMT2AMEN1NPC1
SCHEMBL7162058 0.87 DYRK1A (0.64) RAB9AKMT2AMEN1NPC1POLB
SCHEMBL7127487 0.87 MMP13 (0.74) RAB9AKMT2AMEN1NPC1POLB
SCHEMBL7124297 0.86 DYRK1A (0.61) RAB9AKMT2AMEN1NPC1POLB
SCHEMBL7123602 0.85 DYRK1A (0.67) RAB9AKMT2AMEN1NPC1POLB
SCHEMBL7119606 0.85 MAPT (0.61) RAB9AKMT2AMEN1NPC1POLB
SCHEMBL4921041 0.85 SCD (1.00) SCDRAB9AKMT2AMEN1NPC1
SCHEMBL2481533 0.84 SCD (0.76) SCDRAB9AKMT2AMEN1NPC1
SCHEMBL5731624 0.83 MAPT (0.69) SCDRAB9AKMT2AMEN1NPC1

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-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 SCD 1181/4885RAB9A 1179/4885KMT2A 3291/4885

“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.