SCHEMBL7128951

SCHEMBL7128951

O=C(Nc1cccc2cccnc12)c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.76
RAB9A P51151 2/20 0.76
NPC1 O15118 1/20 0.76
HTT P42858 1/20 0.76
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
RORC P51449 8/20 0.69
KDR P35968 4/20 0.69
MAPT P10636 3/20 0.61
PLEC Q15149 1/20 0.61
LMNA P02545 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
CYP3A4 P08684 1/20 0.58
ALOX15 P16050 1/20 0.58
MAPK1 P28482 1/20 0.58
PPARG P37231 1/20 0.58
PPARA Q07869 1/20 0.58

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
SCHEMBL7263545 0.86 SMN1; SMN2 (1.00) SMN1; SMN2RAB9ANPC1HTTMEN1
SCHEMBL7130542 0.83 MEN1 (1.00) SMN1; SMN2RAB9ANPC1HTTMEN1
SCHEMBL29152823 0.81 RAB9A (1.00) SMN1; SMN2RAB9ANPC1HTTMEN1
SCHEMBL28439885 0.81 KDR (1.00) RAB9ANPC1HTTMEN1KMT2A
SCHEMBL7128932 0.81 SMN1; SMN2 (0.63) SMN1; SMN2RAB9ANPC1HTTMEN1
SCHEMBL7684585 0.80 RAB9A (0.56) SMN1; SMN2RAB9ANPC1HTTMEN1
SCHEMBL29510019 0.80 KDR (1.00) SMN1; SMN2RAB9AMEN1KMT2AKDR
SCHEMBL18146442 0.80 RORC (0.81) SMN1; SMN2RAB9ANPC1HTTMEN1
SCHEMBL27947220 0.80 KDR (1.00) SMN1; SMN2RAB9AMEN1KMT2AKDR
SCHEMBL7129183 0.78 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1HTTMEN1

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 SMN1; SMN2 3743/4885RAB9A 1179/4885NPC1 1152/4885

“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.