SCHEMBL6410294

SCHEMBL6410294

CC(=O)NC1CCC(CCC(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.48
DRD3 P35462 4/20 0.48
HPGD P15428 1/20 0.44
ALDH1A1 P00352 2/20 0.42
KDM5A P29375 1/20 0.39
KDM7A Q6ZMT4 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
ATM Q13315 1/20 0.39
MAPT P10636 1/20 0.38
HTR2A P28223 3/20 0.38
HTR1A P08908 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL9409600 1.00 DRD2 (0.48) DRD2DRD3HPGDALDH1A1KDM5A
SCHEMBL6410297 1.00 DRD2 (0.48) DRD2DRD3HPGDALDH1A1KDM5A
SCHEMBL11687711 0.86 DRD2 (0.50) DRD2DRD3HPGDALDH1A1ATM
SCHEMBL11683857 0.81 DRD2 (0.47) DRD2DRD3HPGDALDH1A1KDM5A
SCHEMBL15788648 0.81 DRD2 (0.43) DRD2DRD3HPGDALDH1A1ATM
SCHEMBL6417470 0.81 DRD2 (0.43) DRD2DRD3HPGDALDH1A1ATM
SCHEMBL225429 0.81 DRD2 (0.47) DRD2DRD3HPGDALDH1A1ATM
SCHEMBL225428 0.81 DRD2 (0.47) DRD2DRD3HPGDALDH1A1ATM
SCHEMBL6417467 0.81 DRD2 (0.43) DRD2DRD3HPGDALDH1A1ATM
SCHEMBL16556614 0.81 DRD2 (0.47) DRD2DRD3HPGDALDH1A1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065140-A1 Serotonine reuptake inhibitor SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2005-03-24 US disclosed
EP-1466901-A1 SEROTONINE REUPTAKE INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-10-13 EP disclosed
CN-1064362-C Pyrimido [5,4-D] pyrimidines, medicaments containing these compounds, their use and process for their production THOMAE GMBH DR K (DE) 2001-04-11 CN disclosed
CN-1047778-C Pyrimido [5-4-d] pyrimidines, drugs containing these compounds, their use and process for preparing them THOMAE GMBH DR K (DE) 1999-12-29 CN disclosed
CN-1212694-A Pyrimido [5,4-D] pyrimidines, medicaments containing these compounds, their use and process for their production THOMAE GMBH DR K (DE) 1999-03-31 CN disclosed
US-5821240-A ENZYME INHIBITORS, SIGNAL INHIBITORS FOR ANTIINFLAMMATORY AGENTS, ANTICARCINOGENIC AGENTS, ANTITUMOR AGENTS AND HORMONE INHIBITORS DR. KARL THOMAE GMBH (DE) 1998-10-13 US disclosed
US-5707989-A ANTITUMOR AGENTS, INHIBITING SIGNAL TRANSDUCTION MEDIATED BY TYROSINE KINASES DR. KARL THOMAE GMBH (DE) 1998-01-13 US disclosed
CN-1157619-A Pyrimido [5-4-d] pyrimidines, drugs containing these compounds, their use and process for preparing them THOMAE GMBH DR K (DE) 1997-08-20 CN disclosed
CN-1094035-A Carboxylic acid derivative contains pharmaceutical composition of these compounds and preparation method thereof THOMAE GMBH DR K (DE) 1994-10-26 CN 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-20050065140-A1 Serotonine reuptake inhibitor HTR1A, SLC6A4, SLC6A2 DRD2 79/4885DRD3 194/4885HPGD 853/4885

“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.