SCHEMBL3136133

SCHEMBL3136133

NC(=O)S(=O)(=O)NC1CCN(C(=O)[CH]Cc2ccc(F)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
EPHX2 P34913 2/20 0.38
TEAD1 P28347 1/20 0.37
TSHR P16473 2/20 0.37
MAPT P10636 1/20 0.37
TNKS O95271 1/20 0.36
PARP1 P09874 1/20 0.36
PARP14 Q460N5 1/20 0.36
SIGMAR1 Q99720 2/20 0.36
PRKAA2 P54646 1/20 0.36
ATM Q13315 1/20 0.36
F10 P00742 1/20 0.36
ALDH1A1 P00352 2/20 0.35

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 0.83 SIGMAR1 (0.44) EPHX2TEAD1SIGMAR1PRKAA2
SCHEMBL3255015 0.81 SIGMAR1 (0.42) EPHX2TEAD1SIGMAR1PRKAA2
SCHEMBL28757734 0.79 CACNA1B (0.50) TSHRALDH1A1
SCHEMBL3140933 0.78 POLB (0.41) TSHRALDH1A1
SCHEMBL4086461 0.77 ADRB2 (0.41) CA12CA1CA2CA9MAPT
SCHEMBL4096230 0.77 TPSAB1 (0.43) TSHRSIGMAR1ALDH1A1
SCHEMBL3137377 0.75 TPSAB1 (0.43) TSHRSIGMAR1F10ALDH1A1
SCHEMBL3131545 0.74 CCR5 (0.41) ATMALDH1A1
SCHEMBL3136194 0.74 SIGMAR1 (0.44) EPHX2TEAD1SIGMAR1PRKAA2
SCHEMBL3133481 0.72 ADRB2 (0.39) EPHX2MAPTF10ALDH1A1

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-1636224-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDE INHIBITORS OF GLYCOGEN PHOSHORYLASE PROSIDION LTD (GB) 2010-07-14 EP 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 (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 CA12 2211/4885CA1 1150/4885CA2 303/4885
US-20050261272-A1 Pyrrolopyridine-2-carboxylic acid amide inhibitors of glycogen phosphorylase PYGL, PYGM, PYGB CA12 2211/4885CA1 1150/4885CA2 303/4885

“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.