SCHEMBL7121697

SCHEMBL7121697

O=C(Nc1ccc(-c2cn3ccccc3n2)cc1)c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.79
SMN1; SMN2 Q16637 6/20 0.60
KMT2A Q03164 6/20 0.60
MAPT P10636 5/20 0.60
KDM4E B2RXH2 5/20 0.60
MEN1 O00255 4/20 0.60
RORC P51449 4/20 0.60
NPC1 O15118 3/20 0.60
MAPK1 P28482 3/20 0.60
ALDH1A1 P00352 3/20 0.60
LMNA P02545 3/20 0.60
CYP2C19 P33261 2/20 0.60
CYP1A2 P05177 2/20 0.60
CYP3A4 P08684 2/20 0.60
PKM P14618 2/20 0.60
HTT P42858 2/20 0.60
TP53 P04637 1/20 0.60
CYP2D6 P10635 1/20 0.60
CYP2C9 P11712 1/20 0.60
TSHR P16473 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
SCHEMBL4728184 0.93 PPARG (0.68) PPARGSMN1; SMN2KMT2AMAPTKDM4E
SCHEMBL27188681 0.89 PPARG (1.00) PPARGSMN1; SMN2KMT2AMAPTKDM4E
SCHEMBL1494680 0.84 NPC1 (0.72) PPARGSMN1; SMN2KMT2AMAPTKDM4E
SCHEMBL7125062 0.79 RORC (0.85) PPARGSMN1; SMN2KMT2AMAPTMEN1
SCHEMBL7127034 0.79 RORC (0.69) PPARGSMN1; SMN2KMT2AMAPTMEN1
SCHEMBL7121705 0.79 RORC (0.80) PPARGSMN1; SMN2KMT2AMAPTMEN1
Hydrochloric Acid SCHEMBL7127092 0.78 RORC (0.67) PPARGSMN1; SMN2KMT2AMAPTMEN1
SCHEMBL27589534 0.78 RORC (0.78) PPARGSMN1; SMN2KMT2AMAPTMEN1
SCHEMBL13381558 0.78 CYP1A2 (0.63) SMN1; SMN2KMT2AMAPTKDM4EMEN1
SCHEMBL7130666 0.78 RORC (0.67) PPARGSMN1; SMN2KMT2AMAPTMEN1

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 PPARG 1/4885SMN1; SMN2 3743/4885KMT2A 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.