SCHEMBL5437592

SCHEMBL5437592

Cc1cc(F)ccc1CN(C(=O)O)c1nccc(C)c1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
POLB P06746 2/20 0.39
ATM Q13315 1/20 0.39
NR3C2 P08235 1/20 0.38
KDM4C Q9H3R0 2/20 0.38
KDM5A P29375 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
LMNA P02545 4/20 0.36
MAPT P10636 5/20 0.35
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPK1 P28482 2/20 0.34
HTT P42858 2/20 0.34
SNCA P37840 2/20 0.34
HPD P32754 1/20 0.34
MMP1 P03956 2/20 0.32

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
SCHEMBL5437601 1.00 SMN1; SMN2 (0.39) SMN1; SMN2POLBATMNR3C2KDM4C
SCHEMBL2473102 0.87 CCNT1 (0.35) SMN1; SMN2POLBATMNR3C2KDM4C
SCHEMBL2473104 0.83 POLB (0.33) SMN1; SMN2POLBATMNR3C2KDM4C
SCHEMBL5439591 0.74 FBP1 (0.33) KDM4CKDM5AKDM5BMAPTALDH1A1
SCHEMBL5439602 0.74 FBP1 (0.33) KDM4CKDM5AKDM5BMAPTALDH1A1
SCHEMBL5439596 0.74 FBP1 (0.33) KDM4CKDM5AKDM5BMAPTALDH1A1
Potassium Ion SCHEMBL2477023 0.72 FBP1 (0.33) MAPT
SCHEMBL2475151 0.72 MAPT (0.30) MAPT
SCHEMBL5572109 0.71 NR3C2 (0.41) SMN1; SMN2NR3C2KDM4CKDM5AKDM5B
SCHEMBL1654086 0.70 KDM4E (0.42) SMN1; SMN2POLBLMNAALDH1A1MEN1

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
EP-1787991-B2 PYRROLO[2,3-c]PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE TAKEDA PHARMACEUTICALS CO (JP) 2020-06-24 EP disclosed
US-20070293532-A1 Pyrrolo [2,3-C] Pyridine Compound, Process for Producing the Same, and Use TAKEDA PHARMACEUTICAL COMPAN6Y LIMITED (JP) 2007-12-20 US disclosed
EP-1787991-A1 PYRROLOÝ2,3-c¨PYRIDINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2007-05-23 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-20070293532-A1 Pyrrolo [2,3-C] Pyridine Compound, Process for Producing the Same, and Use PGA5, ATP6AP1, PPA1 SMN1; SMN2 3534/4885POLB 2482/4885ATM 4683/4885

“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.