SCHEMBL4279264

SCHEMBL4279264

COc1cc2cc(C(=O)Nc3nc(-c4cc(OC)c(Cl)cc4OC)c(CCC4CCCCC4)s3)n(CC(=O)O)c2cn1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
CCKAR P32238 1/20 0.34
KMT2A Q03164 1/20 0.34
TRPV4 Q9HBA0 3/20 0.34
F10 P00742 1/20 0.34
SCN9A Q15858 6/20 0.33
MPL P40238 1/20 0.32
PLTP P55058 2/20 0.32
ECE1 P42892 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
POLQ O75417 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL6703653 0.90 MEN1 (0.37) MEN1CCKARKMT2ATRPV4F10
SCHEMBL7679752 0.89 MEN1 (0.38) MEN1CCKARKMT2ATRPV4MPL
SCHEMBL7684176 0.89 TRPV4 (0.38) MEN1CCKARKMT2ATRPV4ECE1
SCHEMBL7688740 0.89 MEN1 (0.46) MEN1CCKARKMT2ATRPV4F10
SCHEMBL7688727 0.87 TRPV4 (0.36) MEN1CCKARKMT2ATRPV4PLTP
SCHEMBL29403637 0.86 TRPV4 (0.36) MEN1CCKARKMT2ATRPV4PLTP
SCHEMBL1008694 0.86 TRPV4 (0.36) MEN1CCKARKMT2ATRPV4PLTP
SCHEMBL7688378 0.86 MEN1 (0.38) MEN1CCKARKMT2ATRPV4F10
SCHEMBL7688220 0.86 TRPV4 (0.35) MEN1CCKARKMT2ATRPV4PLTP
SCHEMBL7688634 0.86 MEN1 (0.37) MEN1CCKARKMT2ATRPV4PLTP

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
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 US claimed
US-7608627-B2 I kappa B kinase inhibition; diabetes; (7-Chloro-1H-pyrrolo[2,3-c]pyridin-2-yl)methanol; N-Benzyl-7-chloro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-27 US disclosed
US-20080064715-A1 6-Azaindole Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-03-13 US 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-20080064715-A1 6-Azaindole Compound RELA, NFKBIA, GPR119 MEN1 2705/4885CCKAR 203/4885KMT2A 1114/4885

“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.