SCHEMBL5283293

SCHEMBL5283293

CC(c1ccc(Cl)s1)N1CCN(C(=O)c2ccc3cc[nH]c3c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 14/20 0.52
MAPK14 Q16539 2/20 0.51
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
ENPP2 Q13822 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL6096167 0.93 MAPK14 (0.52) GHSRMAPK14DRD2DRD3
SCHEMBL5925665 0.84 GHSR (0.51) GHSRMAPK14DRD2DRD3KDM4E
SCHEMBL5925669 0.82 GHSR (0.56) GHSRMAPK14HPGD
SCHEMBL3249536 0.81 GHSR (0.64) GHSRMAPK14KDM4EALDH1A1HPGD
SCHEMBL6096974 0.79 GHSR (0.57) GHSRMAPK14KDM4EALDH1A1HPGD
SCHEMBL5276413 0.78 MAPK14 (0.53) MAPK14ALDH1A1
SCHEMBL5273569 0.78 HCRTR1 (0.40) MAPK14ALDH1A1HPGD
Hydrochloric Acid SCHEMBL27574061 0.78 GHSR (0.56) GHSRMAPK14KDM4EALDH1A1HPGD
SCHEMBL6097439 0.78 GHSR (0.53) GHSRMAPK14DRD2DRD3KDM4E
SCHEMBL6094856 0.78 MAPK14 (0.51) GHSRMAPK14DRD2DRD3

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
EP-1448201-B1 N-(INDOLCARBONYL-)PIPERAZINE DERIVATIVES FOR THE TREATMENT OF OBESITY MERCK PATENT GMBH (DE) 2007-11-28 EP disclosed
US-7084143-B2 N-(indolecarbonyl) piperazine derivatives MERCK PATENT GMBH (DE) 2006-08-01 US disclosed
US-20060040951-A1 Use of 5-ht2 receptor antagonists for the treatment of sleep disorders MERCK PATENT GMBH (DE) 2006-02-23 US disclosed
US-20050014766-A1 Use of n-(indolecarbonyl-)piperazine derivatives MERCK PATENT GMBH (DE) 2005-01-20 US disclosed
US-6838461-B1 N-(indolcarbonyl-)piperazine derivatives MERCK PATENT GMBH (DE) 2005-01-04 US disclosed
EP-1198453-B9 N-(INDOLCARBONYL-)PIPERAZIN DERIVATIVES MERCK PATENT GMBH (DE) 2004-11-10 EP disclosed
EP-1198453-B1 N-(INDOLCARBONYL-)PIPERAZIN DERIVATIVES MERCK PATENT GMBH (DE) 2003-04-09 EP 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-20050014766-A1 Use of n-(indolecarbonyl-)piperazine derivatives GPR119, CHRM1, HTR1A GHSR 279/4885MAPK14 4344/4885DRD2 17/4885

“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.