SCHEMBL4371869

SCHEMBL4371869

Cc1ccc(P(c2ccc(C)cc2)C(c2ccccc2)C(C)(C(C)C)C(c2ccccc2)P(c2ccc(C)cc2)c2ccc(C)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
KEAP1 Q14145 2/20 0.33
NFE2L2 Q16236 2/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 2/20 0.32
TSHR P16473 1/20 0.32
ALOX12 P18054 1/20 0.32
ACHE P22303 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
SLC6A4 P31645 2/20 0.31
CACNA1F O60840 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31
ADRA2B P18089 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL4378124 0.90 RIPK1 (0.40) RIPK1LMNASLC6A4CACNA1FCHRM2
SCHEMBL4377976 0.87 RIPK1 (0.36) RIPK1SMN1; SMN2SLC6A4CACNA1FCHRM2
SCHEMBL4381943 0.85 RIPK1 (0.35) RIPK1LMNATSHRHRH1OPRK1
SCHEMBL4376392 0.85 SMN1; SMN2 (0.36) RIPK1SMN1; SMN2KEAP1NFE2L2HTT
SCHEMBL4367346 0.84 LMNA (0.36) RIPK1SMN1; SMN2KEAP1NFE2L2HTT
SCHEMBL4376388 0.80 RIPK1 (0.37) RIPK1SMN1; SMN2HTTLMNAMEN1
SCHEMBL4380919 0.79 SMN1; SMN2 (0.37) RIPK1SMN1; SMN2HTTLMNATSHR
SCHEMBL4379459 0.77 RIPK1 (0.38) RIPK1SMN1; SMN2HTTLMNAMEN1
SCHEMBL4369917 0.77 HTT (0.36) SMN1; SMN2HTTLMNATSHRALOX12
SCHEMBL4370181 0.76 RIPK1 (0.33) RIPK1SMN1; SMN2HTTLMNAMEN1

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
EP-2623509-A1 Method of producing an optically active amine compound by catalytic asymmetric hydrogenation using a ruthenium-diphosphine complex Kanto Kagaku Kabushiki Kaisha (JP) 2013-08-07 EP disclosed
US-20130197234-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE AMINE COMPOUND NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2013-08-01 US disclosed
US-8212037-B2 Process for production of optically active quinuclidinols KANTO KAGAKU KABUSHIKI KAISHA (JP) 2012-07-03 US disclosed
US-20090216019-A1 Process for Production of Optically Active Quinuclidinols KANTO KAGAKU KABUSHIKI KAISHA 2009-08-27 US disclosed
EP-1867654-A1 PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE QUINUCLIDINOL Nagoya Industrial Science Research Institute (JP) 2007-12-19 EP disclosed
EP-1323724-B1 Ruthenium complexes and process for preparing alcoholic compounds using these KANTO KAGAKU (JP) 2007-03-14 EP disclosed
US-6790973-B2 REDUCTION OF KETONE TO ALCOHOL USING COMPLEX CATALYST KANTO KAGAKU KABUSHIKI KAISHA (JP) 2004-09-14 US disclosed
US-20030166978-A1 Novel ruthenium complexes and process for preparing alcoholic compounds using these KANTO KAGAKU KABUSHIKI KAISHA (JP) 2003-09-04 US disclosed
EP-1323724-A2 Novel ruthenium complexes and process for preparing alcoholic compounds using these Kanto Kagaku Kabushiki Kaisha (JP) 2003-07-02 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 (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-20090216019-A1 Process for Production of Optically Active Quinuclidinols NQO2, ADH7, MRPL21 RIPK1 941/4885SMN1; SMN2 4694/4885KEAP1 769/4885
US-20130197234-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE AMINE COMPOUND HRH3, TDO2, SRM RIPK1 590/4885SMN1; SMN2 3025/4885KEAP1 2942/4885
US-20030166978-A1 Novel ruthenium complexes and process for preparing alcoholic compounds using these ADH1C, ADH1A, ADH5 RIPK1 1437/4885SMN1; SMN2 4684/4885KEAP1 2068/4885

“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.