SCHEMBL635386

SCHEMBL635386

CN(C)C(=O)[Ru](Cl)Cl.c1ccc(P(c2ccccc2)c2ccc3ccccc3c2-c2c(P(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.38
NCEH1 Q6PIU2 11/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
MAPT P10636 1/20 0.33
LDHA P00338 1/20 0.31
KDM4E B2RXH2 2/20 0.31
SOS1 Q07889 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL635117 0.90 MAPT (0.39) NCEH1LMNAALDH1A1HPGDMAPT
SCHEMBL636417 0.87 NPC1 (0.41) NCEH1LMNAALDH1A1HPGDMAPT
SCHEMBL636039 0.86 NCEH1 (0.33) WDR5NCEH1LMNAALDH1A1HPGD
Acetic Acid SCHEMBL4438549 0.83 WDR5 (0.49) WDR5ALDH1A1HPGDMAPTLDHA
SCHEMBL636437 0.83 NCEH1 (0.34) NCEH1LMNAALDH1A1HPGDKDM4E
Acetic Acid SCHEMBL28652453 0.82 WDR5 (0.47) WDR5ALDH1A1HPGDMAPTLDHA
Acetic Acid SCHEMBL29392612 0.82 WDR5 (0.47) WDR5ALDH1A1HPGDMAPTLDHA
Acetic Acid SCHEMBL446685 0.81 WDR5 (0.46) WDR5ALDH1A1HPGDMAPTLDHA
Acetic Acid SCHEMBL29430099 0.81 WDR5 (0.46) WDR5ALDH1A1HPGDMAPTLDHA
Acetic Acid SCHEMBL6600591 0.81 WDR5 (0.46) WDR5ALDH1A1HPGDMAPTLDHA

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-8981147-B2 Diphosphine ligand and transition metal complex using the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-03-17 US disclosed
US-20140171655-A1 DIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX USING THE SAME TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-06-19 US disclosed
EP-1927596-B9 DIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX USING THE SAME TAKEDA PHARMACEUTICAL (JP) 2013-05-15 EP disclosed
EP-1927596-B1 DIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX USING THE SAME TAKEDA PHARMACEUTICAL (JP) 2012-08-01 EP disclosed
EP-2420507-A1 Diphosphine ligand and transition metal complex using the same Takeda Pharmaceutical Company Limited (JP) 2012-02-22 EP disclosed
US-20090270635-A1 Diphosphine Ligand and Transition Metal Complex Using the Same TAKEDA PHARMACEUTICAL COMPANY LIMITED 2009-10-29 US disclosed
EP-1927596-A1 DIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX USING THE SAME Takeda Pharmaceutical Company Limited (JP) 2008-06-04 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 (2 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-20090270635-A1 Diphosphine Ligand and Transition Metal Complex Using the Same MVD, C5, C1S WDR5 639/4885NCEH1 3673/4885LMNA 4816/4885
US-20140171655-A1 DIPHOSPHINE LIGAND AND TRANSITION METAL COMPLEX USING THE SAME MVD, C5, C1S WDR5 639/4885NCEH1 3673/4885LMNA 4816/4885

“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.