SCHEMBL7128928

SCHEMBL7128928

NCCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 8/20 0.67
KMT2A Q03164 5/20 0.67
PPARG P37231 4/20 0.67
MEN1 O00255 4/20 0.67
MAPT P10636 4/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
CYP3A4 P08684 2/20 0.67
MAPK1 P28482 2/20 0.67
LMNA P02545 1/20 0.67
TP53 P04637 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2D6 P10635 1/20 0.67
CYP2C9 P11712 1/20 0.67
PKM P14618 1/20 0.67
TSHR P16473 1/20 0.67
NFKB1 P19838 1/20 0.67
CYP2C19 P33261 1/20 0.67
THPO P40225 1/20 0.67
MTOR P42345 1/20 0.67
PMP22 Q01453 1/20 0.67

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
Hydrochloric Acid SCHEMBL7120692 0.99 RORC (0.66) RORCKMT2APPARGMEN1MAPT
SCHEMBL27589540 0.90 RORC (0.70) RORCKMT2APPARGMEN1MAPT
SCHEMBL7122896 0.89 RORC (0.69) RORCKMT2APPARGMEN1MAPT
SCHEMBL7119644 0.88 PPARG (0.67) RORCKMT2APPARGMEN1MAPT
SCHEMBL7130748 0.86 KMT2A (0.62) RORCKMT2APPARGMEN1MAPT
SCHEMBL7121675 0.86 RORC (0.76) RORCKMT2APPARGMEN1MAPT
SCHEMBL7130609 0.86 RORC (0.84) RORCKMT2APPARGMEN1MAPT
SCHEMBL7131095 0.85 PPARG (0.70) RORCKMT2APPARGMEN1MAPT
SCHEMBL5657987 0.85 RORC (0.67) RORCKMT2APPARGMEN1MAPT
SCHEMBL7128819 0.85 PPARG (0.63) RORCKMT2APPARGMEN1MAPT

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 4 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 claimed
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 RORC 67/4885KMT2A 3291/4885PPARG 1/4885

“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.