SCHEMBL4296419

SCHEMBL4296419

CC(C)(C)OC(=O)NCc1cc(Cl)ccc1NC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
GAA P10253 1/20 0.43
PTGER1 P34995 2/20 0.42
CYP2C9 P11712 1/20 0.42
ALDH1A1 P00352 5/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
XBP1 P17861 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ANO1 Q5XXA6 1/20 0.41
KDM4A O75164 1/20 0.41
HDAC1 Q13547 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL1018204 0.86 IDO1 (0.43) IDO1GAAPTGER1ALDH1A1HPGD
SCHEMBL6921464 0.85 IDO1 (0.50) IDO1GAAPTGER1ALDH1A1HPGD
SCHEMBL12502538 0.85 AAK1 (0.48) KDM4AHDAC1SMN1; SMN2
SCHEMBL23979460 0.84 IDO1 (0.47) IDO1GAAPTGER1CYP2C9ALDH1A1
SCHEMBL21734883 0.82 IDO1 (0.44) IDO1GAAPTGER1CYP2C9ALDH1A1
SCHEMBL27988801 0.82 IDO1 (0.53) IDO1GAAALDH1A1HPGDHTT
SCHEMBL31718056 0.82 SLC6A4 (0.43) IDO1GAAPTGER1CYP2C9MEN1
SCHEMBL16799845 0.82 SLC6A4 (0.43) IDO1GAAPTGER1CYP2C9MEN1
SCHEMBL23997640 0.81 IDO1 (0.52) IDO1GAAALDH1A1HPGDHTT
SCHEMBL3734185 0.81 ANO1 (0.51) IDO1GAAALDH1A1HPGDHTT

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
EP-2271624-B9 IMINOPYRIDINE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2014-11-12 EP disclosed
EP-2271624-B1 IMINOPYRIDINE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2014-05-21 EP disclosed
US-8481569-B2 Iminopyridine derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-07-09 US disclosed
US-20090270393-A1 Iminopyridine Derivatives and Use Thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-29 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-20090270393-A1 Iminopyridine Derivatives and Use Thereof ADRA1D, ADRB1, ADRB2 IDO1 63/4885GAA 3428/4885PTGER1 176/4885

“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.