SCHEMBL978323

SCHEMBL978323

CCOC(=O)C1C(=O)CCN(N2CCCCC2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
TLR4 O00206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPK1 P28482 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL4718434 1.00 ALDH1A1 (0.44) ALDH1A1HSD17B10KMT2AMEN1TLR4
SCHEMBL6098996 0.84 ALDH1A1 (0.49) ALDH1A1HSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL4475842 0.84 BRD4 (0.35) ALDH1A1HSD17B10KMT2AMEN1SMN1; SMN2
SCHEMBL1303947 0.77 ALDH1A1 (0.39) ALDH1A1HSD17B10KMT2AMEN1TLR4
SCHEMBL6646578 0.77 ACE (0.31) KMT2A
SCHEMBL3286134 0.76 POLB (0.43) ALDH1A1KMT2AMEN1TLR4SMN1; SMN2
SCHEMBL3367604 0.76 ALDH1A1 (0.39) ALDH1A1HSD17B10KMT2AMEN1TLR4
SCHEMBL22216375 0.74 POLB (0.44) ALDH1A1KMT2AMEN1TLR4SMN1; SMN2
SCHEMBL22216157 0.74 POLB (0.41) ALDH1A1KMT2AMEN1TLR4SMN1; SMN2
SCHEMBL23907332 0.74 MAPT (0.51) ALDH1A1HSD17B10KMT2AMEN1TLR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875626-B2 3,3,3-trifluoropropane-1-sulfonic acid 4-[1-(2-chlorophenyl)-3-methyl-4-oxo-5-piperidin-1-yl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine-2-yl]phenyl ester; treatment of obesity, psychiatric and neurological disorders ASTRAZENECA AB (SE) 2011-01-25 US disclosed
EP-1937679-B1 PREPARATION AND USE OF TETRAHYDROPYRROLO [3, 2-C] PYRIDIN-4-ONE DERIVATIVES FOR TREATMENT OF OBESITY, PSYCHIATRIC AND NEUROLOGICAL DISORDERS ASTRAZENECA AB (SE) 2009-08-19 EP disclosed
US-7576095-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-08-18 US disclosed
US-20080312269-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-12-18 US disclosed
US-20080262026-A1 Therapeutic Agents 684 ASTRAZENECA AB (SE) 2008-10-23 US disclosed
US-20080214611-A1 Pharmaceutical Compositions - 659 ASTRAZENECA AB (SE) 2008-09-04 US disclosed
US-20080009513-A1 Therapeutic agents ASTRAZENECA AB (SE) 2008-01-10 US disclosed
US-7071207-B2 Preparation and use of 1,5,6,7-tetrahydropyrrolo[3,2-c]pyridine derivatives for treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2006-07-04 US disclosed
US-20060122215-A1 Preparation and use of 1,5,6,7-tetrahydropyrrolo[3,2-C]pyridine derivatives for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION (US) 2006-06-08 US disclosed
EP-1432708-B1 PREPARATION AND USE OF 1,5,6,7-TETRAHYDROPYRROLO 3,2-C]PYRIDINE DERIVATIVES FOR TREATMENT OF OBESITY BAYER PHARMACEUTICALS CORP (US) 2005-11-30 EP disclosed
US-20040224970-A1 Preparation and use of 1,5,6,7-tetrahydropyrrolo[3,2-c]pyridine derivatives for treatment of obesity BAYER PHARMACEUTICALS CORPORATION 2004-11-11 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 (6 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-20080262026-A1 Therapeutic Agents 684 GPR119, NLN, PYGB ALDH1A1 618/4885HSD17B10 1050/4885KMT2A 2968/4885
US-20080009513-A1 Therapeutic agents NLN, GPR119, FABP4 ALDH1A1 403/4885HSD17B10 490/4885KMT2A 3490/4885
US-20040224970-A1 Preparation and use of 1,5,6,7-tetrahydropyrrolo[3,2-c]pyridine derivatives for treatment of obesity GPR119, GIPR, PGC ALDH1A1 3534/4885HSD17B10 2730/4885KMT2A 1681/4885
US-20080312269-A1 Therapeutic Agents NLN, GRIN2C, GPR119 ALDH1A1 612/4885HSD17B10 911/4885KMT2A 3667/4885
US-20060122215-A1 Preparation and use of 1,5,6,7-tetrahydropyrrolo[3,2-C]pyridine derivatives for the treatment of obesity GPR119, GIPR, PGC ALDH1A1 2626/4885HSD17B10 1298/4885KMT2A 1796/4885
US-20080214611-A1 Pharmaceutical Compositions - 659 CNR1, CNR2, GPR18 ALDH1A1 4335/4885HSD17B10 3026/4885KMT2A 3812/4885

“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.