SCHEMBL4933217

SCHEMBL4933217

COC(=O)c1ccc(CC2CNCCN2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
OPRD1 P41143 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.43
GLA P06280 1/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA4 P22748 2/20 0.42
CA9 Q16790 2/20 0.42
HRH1 P35367 1/20 0.42
CHKA P35790 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP4A11 Q02928 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL4149173 0.85 CA1 (0.47) CA1CA2CA4CA9ALDH1A1
SCHEMBL27657936 0.80 OPRD1 (0.46) MAPTLMNAOPRD1GLAATM
SCHEMBL12520753 0.80 SLC6A2 (0.44)
SCHEMBL4934485 0.79 SLC6A2 (0.47) CA1CA2CA4CA9
SCHEMBL28475644 0.76 SLC6A2 (0.47)
SCHEMBL6926417 0.76 SLC6A2 (0.65) CA1CA2CA4CA9
SCHEMBL10413244 0.76 SLC6A2 (0.65) CA1CA2CA4CA9
SCHEMBL22285003 0.76 SLC6A2 (0.65) CA1CA2CA4CA9
SCHEMBL20333302 0.75 KDM4E (0.47) MAPTLMNAOPRD1LOXL2CHKA
SCHEMBL28403717 0.73 KCNJ1 (0.52) MAPTLMNAOPRD1LOXL2GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501828-B1 PIPERAZINE BENZOTHIAZOLES AS AGENTS FOR THE TREATMENT OF CEREBRAL ISCHEMIC DISORDERS OR CNS DISORDERS SERONO LAB (CH) 2008-01-09 EP disclosed
US-7314878-B2 Piperazine benzothiazoles as agents for the treatment of cerebral ischemic disorders or CNS disorders LABORATORIES SERONO SA (CH) 2008-01-01 US disclosed
US-20050261304-A1 Piperazine benzothiazoles as agents for the treatment of cerebral ischemic disorders or cns disorders APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2005-11-24 US disclosed
EP-1501828-A1 PIPERAZINE BENZOTHIAZOLES AS AGENTS FOR THE TREATMENT OF CEREBRAL ISCHEMIC DISORDERS OR CNS DISORDERS Applied Research Systems ARS Holding N.V. (AN) 2005-02-02 EP disclosed
WO-2003091249-A1 PIPERAZINE BENZOTHIAZOLES AS AGENTS FOR THE TREATMENT OF CEREBRAL ISCHEMIC DISORDERS OR CNS DISORDERS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-11-06 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-20050261304-A1 Piperazine benzothiazoles as agents for the treatment of cerebral ischemic disorders or cns disorders PRDX5, PIR, GRIK5 MAPT 306/4885LMNA 3715/4885OPRD1 3151/4885

“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.