SCHEMBL7070179

SCHEMBL7070179

C(C=Cc1ccccc1)=Cc1ccccc1.C1=CCC(N=P(C2CCCCC2)(C2CCCCC2)C2CCCCC2)=C1.[Ti]

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
HSP90AA1 P07900 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
ALOX12 P18054 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.30
CHRNA7 P36544 2/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA10 Q9GZZ6 1/20 0.30
CHRNA9 Q9UGM1 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
SCHEMBL7071323 0.99 MAOB (0.37) MAOBPOLBRAB9AHSP90AA1MAPK1
SCHEMBL7072706 0.94 POLB (0.33) MAOBPOLBRAB9AHSP90AA1MAPK1
SCHEMBL7069364 0.93 POLB (0.32) MAOBPOLBRAB9AHSP90AA1MAPK1
SCHEMBL7069069 0.81
SCHEMBL7069301 0.80
SCHEMBL7073402 0.79 MAOB (0.44) MAOBPOLBRAB9AMAPK1SMN1; SMN2
Butadiene SCHEMBL7069092 0.79
SCHEMBL7072677 0.79
SCHEMBL7069129 0.78
SCHEMBL7069006 0.78

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 MAOB 1280/4885POLB 1256/4885RAB9A 2938/4885

“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.