SCHEMBL7072597

SCHEMBL7072597

C(C=Cc1ccccc1)=Cc1ccccc1.CCCCC(C)P(=NC1=CC=CC1)(C(C)CCCC)C(C)CCCC.[Ti]

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.34
MAOB P27338 1/20 0.33
LMNA P02545 2/20 0.32
TSHR P16473 1/20 0.32
EGFR P00533 1/20 0.31
HDAC3 O15379 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7070671 0.94 TDP1 (0.33) TDP1LMNATSHR
SCHEMBL7070302 0.93 MAOB (0.34) TDP1MAOBLMNANPC1RAB9A
SCHEMBL7073901 0.88 MAOB (0.36) TDP1MAOBLMNAKDM4ENPC1
SCHEMBL7069012 0.87
SCHEMBL7075341 0.82 MAOB (0.40) MAOBLMNAHDAC3
SCHEMBL7074498 0.82 MEN1 (0.33) MAOBLMNAKDM4ENPC1RAB9A
SCHEMBL7070780 0.82
SCHEMBL7072696 0.82
SCHEMBL7075339 0.81
Butadiene SCHEMBL7071474 0.81

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-20030109730-A1 Transition metal compound, addition polymerization catalyst component, addition polymerization catalyst and process for production of olefin polymer NABIKA MASAAKI (JP) 2003-06-12 US disclosed
US-6528671-B1 Such as cyclopentadienyl-trimethylphosphineimine-1,4-di-phenyl butandiene titanium complex; copolymerization of ethylene with other alpha-olefins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-04 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-20030109730-A1 Transition metal compound, addition polymerization catalyst component, addition polymerization catalyst and process for production of olefin polymer ARL1, AP2M1, AP1M1 TDP1 4039/4885MAOB 1280/4885LMNA 4094/4885

“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.