SCHEMBL6909631

SCHEMBL6909631

CC(C)Sc1cccc(N(C)C)c1O[Zr](Cl)(Cl)Oc1c(SC(C)C)cccc1N(C)C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL6905327 0.81 KDM4E (0.32) KDM4EGAAMAPT
Hydrochloric Acid SCHEMBL6909629 0.78 KDM4E (0.32) KDM4EGAAMAPT
SCHEMBL6909079 0.78 GABRA1 (0.34) KDM4EGAAMAPT
SCHEMBL6909663 0.75 KDM4E (0.36) KDM4EGAAMAPT
SCHEMBL6902154 0.71 CA2 (0.34) KDM4EGAAMAPT
SCHEMBL6902166 0.71 DRD1 (0.33)
SCHEMBL6908459 0.65 MAPT (0.36) KDM4EGAAMAPT
SCHEMBL30548758 0.62 MAP2K7 (0.41) KDM4EMAPT
SCHEMBL200411 0.61 MAP2K7 (0.42)
SCHEMBL6909646 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730626-B2 TRANSITION METAL DERIVATIVE CAN REACT TO FORM AN IONIC COMPLEX WITH THE ALUMINOXANE IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-05-04 US disclosed
US-20020193536-A1 Transition metal compound, polymerization catalysts for olefins, olefin polymers and process for their production IDEMITSU KOSAN CO. LTD. (JP) 2002-12-19 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 (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-20020193536-A1 Transition metal compound, polymerization catalysts for olefins, olefin polymers and process for their production CCNE2, PYM1, AP1M1 KDM4E 655/4885GAA 4417/4885MAPT 2296/4885

“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.