SCHEMBL2607002

SCHEMBL2607002

O=C(N[C@@H](Cc1ccc(F)cc1)C(=O)NCCN1CCOCC1)c1cc2cc(Cl)ncc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TACR2 P21452 8/20 0.49
CYP51A1 Q16850 3/20 0.48
PYGL P06737 2/20 0.48
PYGM P11217 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 1/20 0.45
HTR3A P46098 1/20 0.43
MDM2 Q00987 1/20 0.42
ULK1 O75385 1/20 0.42
CD274 Q9NZQ7 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL2606816 0.95 TACR2 (0.55) TACR2CYP51A1PYGLPYGM
SCHEMBL2606937 0.92 TACR2 (0.56) TACR2CYP51A1PYGLKDM4EALDH1A1
SCHEMBL2606902 0.86 CYP51A1 (0.61) CYP51A1PYGLPYGM
SCHEMBL2606997 0.85 PYGL (0.48) CYP51A1PYGLPYGM
SCHEMBL2607067 0.84 PYGL (0.47) CYP51A1PYGLPYGM
SCHEMBL2607018 0.83 PYGL (0.46) CYP51A1PYGLPYGM
SCHEMBL2606853 0.83 PYGL (0.46) CYP51A1PYGLPYGM
SCHEMBL2606895 0.83 PYGL (0.49) CYP51A1PYGLPYGM
SCHEMBL2607006 0.83 PYGL (0.50) CYP51A1PYGLPYGM
SCHEMBL2606910 0.82 PYGL (0.49) CYP51A1PYGLPYGM

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158622-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2012-04-17 US disclosed
US-8158622-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2012-04-17 US disclosed
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2009-01-22 US disclosed
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2009-01-22 US disclosed
US-7405210-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase OSI PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
US-7405210-B2 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase OSI PHARMACEUTICALS, INC. (US) 2008-07-29 US disclosed
US-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE BRADLEY STUART E 2007-10-18 US disclosed
US-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE BRADLEY STUART E 2007-10-18 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 (2 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-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE PYGL, PYGM, PYGB TACR2 4059/4885CYP51A1 598/4885PYGL 1/4885
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB TACR2 4059/4885CYP51A1 598/4885PYGL 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.