SCHEMBL1632308

SCHEMBL1632308

CC1(C)C(=O)NCCN1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
CNR2 P34972 1/20 0.37
TSHR P16473 1/20 0.34
PARP1 P09874 1/20 0.34
NPSR1 Q6W5P4 1/20 0.32
RORC P51449 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
FAAH O00519 1/20 0.30
NAAA Q02083 1/20 0.30

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
SCHEMBL17162718 0.85 SMN1; SMN2 (0.39) SMN1; SMN2CNR2TSHRPARP1NPSR1
SCHEMBL3212643 0.83 SMN1; SMN2 (0.39) SMN1; SMN2CNR2TSHRPARP1NPSR1
SCHEMBL13223504 0.81 SMN1; SMN2 (0.38) SMN1; SMN2CNR2TSHRPARP1NPSR1
SCHEMBL3542786 0.80 SMN1; SMN2 (0.45) SMN1; SMN2CNR2TSHRPARP1RORC
SCHEMBL10738631 0.79 SMN1; SMN2 (0.39) SMN1; SMN2CNR2PARP1
SCHEMBL3210068 0.79 SMN1; SMN2 (0.44) SMN1; SMN2CNR2TSHRPARP1NPSR1
SCHEMBL10734073 0.79 SMN1; SMN2 (0.37) SMN1; SMN2CNR2PARP1RORC
SCHEMBL1583189 0.78 POLB (0.41) SMN1; SMN2CNR2TSHRPOLBKMT2A
SCHEMBL1632144 0.76 MAPK1 (0.41) SMN1; SMN2CNR2ALDH1A1
SCHEMBL9234226 0.74 OPRM1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101842373-B 6-phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives as cathepsin inhibitors ORGANON NV 2013-12-18 CN disclosed
US-7932251-B2 6-phenyl-1H-imidazo[4,5-c]pyridine-4-carbonitrile derivatives N.V. ORGANON (NL) 2011-04-26 US disclosed
EP-2178873-B1 6-PHENYL-1H-IMIDAZO[4,5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN INHIBITORS ORGANON NV (NL) 2010-12-22 EP disclosed
CN-101842373-A 6-phenyl-1H-imidazo [4,5-c] pyridine-4-6-carbonitrile derivatives as cathepsin inhibitors ORGANON NV 2010-09-22 CN disclosed
EP-2178873-A1 6-PHENYL-1H-IMIDAZO[4,5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN INHIBITORS N.V. Organon (NL) 2010-04-28 EP disclosed
US-20090099172-A1 6-PHENYL-1H-IMIDAZO[4,5-c]PYRIDINE-4-CARBONITRILE DERIVATIVES N. V. ORGANON 2009-04-16 US disclosed
WO-2009010491-A1 6-PHENYL-1H-IMIDAZO[4,5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN INHIBITORS N.V. ORGANON (NL) 2009-01-22 WO 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-20090099172-A1 6-PHENYL-1H-IMIDAZO[4,5-c]PYRIDINE-4-CARBONITRILE DERIVATIVES CTSS, CTSV, CTSB SMN1; SMN2 4025/4885CNR2 111/4885TSHR 4483/4885

“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.