SCHEMBL3136194

SCHEMBL3136194

NC(=O)N1CCC(NC(=O)[CH]Cc2ccc(F)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.44
EPHX2 P34913 1/20 0.44
KMT2A Q03164 2/20 0.43
PKM P14618 1/20 0.42
PRKAA2 P54646 2/20 0.42
SLC6A12 P48065 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41
MCHR1 Q99705 1/20 0.41
CCR3 P51677 2/20 0.41
TEAD1 P28347 1/20 0.40
RECQL P46063 1/20 0.40
MEN1 O00255 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
SCHEMBL3145712 0.82 SIGMAR1 (0.44) SIGMAR1EPHX2KMT2APKMPRKAA2
SCHEMBL3255015 0.81 SIGMAR1 (0.42) SIGMAR1EPHX2KMT2APKMPRKAA2
SCHEMBL3136133 0.74 CA12 (0.38) SIGMAR1EPHX2PRKAA2TEAD1
SCHEMBL7470380 0.73 KMT2A (0.50) EPHX2KMT2A
SCHEMBL5806708 0.73 MEN1 (0.55) KMT2ACCR3MEN1
SCHEMBL28757734 0.72 CACNA1B (0.50) KMT2A
Hydrochloric Acid SCHEMBL27943768 0.72 MEN1 (0.54) KMT2ACCR3MEN1
SCHEMBL2985313 0.71 F2 (0.47) EPHX2KMT2AMEN1
SCHEMBL4086461 0.71 ADRB2 (0.41) KMT2A
SCHEMBL4670784 0.71 SIGMAR1 (0.41) SIGMAR1PRKAA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636224-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSHORYLASE PROSIDION LTD (GB) 2010-07-14 EP 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-20070244090-A9 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSPHORYLASE BRADLEY STUART E 2007-10-18 US disclosed
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PROSIDION LIMITED (GB) 2005-11-24 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 (3 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 SIGMAR1 4002/4885EPHX2 1324/4885KMT2A 2476/4885
US-20090023703-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB SIGMAR1 4002/4885EPHX2 1324/4885KMT2A 2476/4885
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB SIGMAR1 4002/4885EPHX2 1324/4885KMT2A 2476/4885

“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.