SCHEMBL978528

SCHEMBL978528

CC(=O)CNc1ccc(Cl)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.53
USP2 O75604 1/20 0.53
MRGPRX4 Q96LA9 1/20 0.49
PDK1 Q15118 1/20 0.45
PDK2 Q15119 1/20 0.45
PDK3 Q15120 1/20 0.45
PDK4 Q16654 1/20 0.45
LMNA P02545 4/20 0.45
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ALDH1A1 P00352 3/20 0.45
ALOX12 P18054 1/20 0.45
POLB P06746 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44

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
SCHEMBL5841965 0.84 MRGPRX4 (0.54) HPGDUSP2MRGPRX4LMNAGAA
SCHEMBL6321530 0.82 MRGPRX4 (0.49) HPGDUSP2MRGPRX4PDK1PDK2
SCHEMBL10751701 0.80 LMNA (0.55) HPGDUSP2MRGPRX4LMNAGAA
SCHEMBL980656 0.78 MEN1 (0.49) HPGDLMNAALDH1A1POLBNPC1
SCHEMBL28463837 0.78 MRGPRX4 (0.43) HPGDUSP2MRGPRX4ALDH1A1POLB
SCHEMBL31590796 0.77 HPGD (0.68) HPGDUSP2LMNAGAASMN1; SMN2
SCHEMBL9180503 0.77 HPGD (0.68) HPGDUSP2LMNAGAASMN1; SMN2
SCHEMBL19707579 0.77 MRGPRX4 (0.58) HPGDUSP2MRGPRX4LMNAGAA
SCHEMBL4311940 0.76 KDM4E (0.66) HPGDUSP2PDK1PDK2PDK3
SCHEMBL29822237 0.76 KDM4E (0.66) HPGDUSP2PDK1PDK2PDK3

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 17 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
WO-2008119999-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2008-10-09 WO disclosed
US-20080214611-A1 Pharmaceutical Compositions - 659 ASTRAZENECA AB (SE) 2008-09-04 US disclosed
WO-2008096151-A1 PHARMACEUTICAL COMPOSITIONS OF CB1 MODULATORS ASTRAZENECA AB (SE) 2008-08-14 WO disclosed
EP-1937679-A2 PREPARATION AND USE OF TETRAHYDROPYRROLO [3, 2-C] PYRIDIN-4-ONE DERIVATIVES FOR TREATMENT OF OBESITY, PSYCHIATRIC AND NEUROLOGICAL DISORDERS AstraZeneca AB (SE) 2008-07-02 EP disclosed
US-20080009513-A1 Therapeutic agents ASTRAZENECA AB (SE) 2008-01-10 US disclosed
WO-2007039740-A2 PREPARATION AND USE OF TETRAHYDROPYRROLO [3, 2-C] PYRIDIN-4-ONE DERIVATIVES FOR TREATMENT OF OBESITY, PSYCHIATRIC AND NEUROLOGICAL DISORDERS ASTRAZENECA AB (SE) 2007-04-12 WO 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
EP-1432708-A1 PREPARATION AND USE OF 1,5,6,7-TETRAHYDROPYRROLO 3,2-C]PYRIDINE DERIVATIVES FOR TREATMENT OF OBESITY Bayer Pharmaceuticals Corporation (US) 2004-06-30 EP disclosed
WO-2003027114-A1 PREPARATION AND USE OF 1,5,6,7-TETRAHYDROPYRROLO[3,2-C]PYRIDINE DERIVATIVES FOR TREATMENT OF OBESITY BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 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 (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 HPGD 835/4885USP2 4406/4885MRGPRX4 997/4885
US-20080009513-A1 Therapeutic agents NLN, GPR119, FABP4 HPGD 565/4885USP2 4476/4885MRGPRX4 1456/4885
US-20040224970-A1 Preparation and use of 1,5,6,7-tetrahydropyrrolo[3,2-c]pyridine derivatives for treatment of obesity GPR119, GIPR, PGC HPGD 950/4885USP2 2402/4885MRGPRX4 600/4885
US-20080312269-A1 Therapeutic Agents NLN, GRIN2C, GPR119 HPGD 806/4885USP2 4378/4885MRGPRX4 1160/4885
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 HPGD 473/4885USP2 3022/4885MRGPRX4 1055/4885
US-20080214611-A1 Pharmaceutical Compositions - 659 CNR1, CNR2, GPR18 HPGD 1223/4885USP2 1680/4885MRGPRX4 168/4885

“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.