SCHEMBL7128932

SCHEMBL7128932

O=C(Nc1cccc2scnc12)c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.63
NPC1 O15118 1/20 0.63
HTT P42858 1/20 0.63
RAB9A P51151 1/20 0.63
RORC P51449 11/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
MAPT P10636 4/20 0.59
LMNA P02545 3/20 0.56
NCOA3 Q9Y6Q9 1/20 0.56
CYP3A4 P08684 2/20 0.55
MAPK1 P28482 2/20 0.55
PPARG P37231 2/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
PKM P14618 1/20 0.55
TSHR P16473 1/20 0.55
NFKB1 P19838 1/20 0.55

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
SCHEMBL7128951 0.81 SMN1; SMN2 (0.76) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL18146442 0.78 RORC (0.81) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL7263545 0.78 SMN1; SMN2 (1.00) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL7130662 0.76 RORC (0.73) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL6298011 0.76 RORC (1.00) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL3832886 0.76 RORC (0.77) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL7121680 0.75 KMT2A (0.61) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL7130542 0.75 MEN1 (1.00) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL18147200 0.75 RORC (0.82) SMN1; SMN2NPC1HTTRAB9ARORC
SCHEMBL29568686 0.75 RORC (1.00) SMN1; SMN2NPC1HTTRAB9ARORC

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 SMN1; SMN2 3743/4885NPC1 1152/4885HTT 4694/4885

“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.