SCHEMBL2295519

SCHEMBL2295519

C[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(OCc3ccccc3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 1/20 0.47
HRH3 Q9Y5N1 2/20 0.45
CNR2 P34972 1/20 0.43
FDFT1 P37268 1/20 0.42
BCHE P06276 2/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
ALOX5 P09917 1/20 0.40
MAPK1 P28482 1/20 0.39

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
SCHEMBL2297996 1.00 CHRM4 (0.47) CHRM4HRH3CNR2FDFT1BCHE
SCHEMBL2295049 1.00 CHRM4 (0.47) CHRM4HRH3CNR2FDFT1BCHE
SCHEMBL2295867 1.00 CHRM4 (0.47) CHRM4HRH3CNR2FDFT1BCHE
SCHEMBL9906056 0.85 LMNA (0.46) HRH3CNR2KMT2A
SCHEMBL2291186 0.81 NPC1 (0.50) HRH3CNR2FDFT1KMT2ATP53
SCHEMBL2298061 0.81 NPC1 (0.50) HRH3CNR2FDFT1KMT2ATP53
SCHEMBL2299687 0.80 MOGAT2 (0.43) HRH3CNR2
SCHEMBL2296463 0.80 MOGAT2 (0.43) HRH3CNR2
SCHEMBL2294914 0.80 MOGAT2 (0.43) HRH3CNR2
SCHEMBL2298058 0.80 MOGAT2 (0.43) HRH3CNR2

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
US-20090156804-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-06-18 US claimed
US-20110257392-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI-AVENTIS (FR) 2011-10-20 US disclosed
US-20110251385-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI-AVENTIS (FR) 2011-10-13 US disclosed
US-7994315-B2 Intermediate compound for synthesizing pharmaceutical agent and production method thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 US disclosed
EP-2221305-A1 Method for synthesizing intermediate compound for synthesizing a pharmaceutical agent Mitsubishi Tanabe Pharma Corporation (JP) 2010-08-25 EP disclosed
EP-2221304-A1 Method for synthesizing intermediate compound for synthesizing a pharmaceutical agent Mitsubishi Tanabe Pharma Corporation (JP) 2010-08-25 EP disclosed
US-20090156804-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-06-18 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 (3 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-20110257392-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 CHRM4 695/4885HRH3 4129/4885CNR2 4163/4885
US-20110251385-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 CHRM4 695/4885HRH3 4129/4885CNR2 4163/4885
US-20090156804-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 CHRM4 695/4885HRH3 4129/4885CNR2 4163/4885

“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.