SCHEMBL5476657

SCHEMBL5476657

COc1cccc(CP(c2ccccc2)c2ccccc2)c1-c1ccccc1CP(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 1/20 0.38
▸ ELANE P08246 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ MAPT P10636 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ DUSP3 P51452 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ IDO1 P14902 2/20 0.37
▸ TAAR1 Q96RJ0 1/20 0.37
▸ GAA P10253 2/20 0.36
▸ RECQL P46063 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA7 P43166 2/20 0.36

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
SCHEMBL21530764 0.84 PDCD1 (0.32) TDP1
SCHEMBL9405344 0.82 IDO1 (0.48) ALDH1A1MAPTMEN1KMT2AIDO1
SCHEMBL720169 0.76 CYP3A4 (0.38) KMT2ATDP1
SCHEMBL13324254 0.76 CYP3A4 (0.38) TDP1
SCHEMBL5398197 0.76 ABCB1 (0.40) MEN1KMT2AIDO1TAAR1CHRM2
SCHEMBL14050273 0.75 CA1 (0.44) ALDH1A1MAPTKDM4ETDP1IDO1
SCHEMBL12050455 0.74 IDO1 (0.41) ALDH1A1MAPTMEN1KMT2AIDO1
SCHEMBL29695439 0.74 CYP3A4 (0.36) KMT2ATDP1
Potassium SCHEMBL30843013 0.74 CYP3A4 (0.36) KMT2ATDP1
Phosphine SCHEMBL29173742 0.74 CYP3A4 (0.36) KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160835-B2 2,2'-bis(diphenylphosphinomethyl)diphenyl ethers compleed with rhodium, cobalt, ruthenium or iron compounds as hydroformylation catalysts for the hydroformylation of ethylenically unsaturated compounds; by-product inhibition; improved industrial scale reaction rates KURARAY CO., LTD. (JP) 2007-01-09 — — US disclosed
US-20050164874-A1 2,2'-bis(diphenylphosphinomethyl)diphenyl ethers compleed with rhodium, cobalt, ruthenium or iron compounds as hydroformylation catalysts for the hydroformylation of ethylenically unsaturated compounds; by-product inhibition; improved industrial scale reaction rates KURARAY CO., LTD. (JP) 2005-07-28 — — US disclosed
EP-1489087-A1 BISPHOSPHINE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Kuraray Co., Ltd. (JP) 2004-12-22 — — 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 (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-20050164874-A1 2,2'-bis(diphenylphosphinomethyl)diphenyl ethers compleed with rhodium, cobalt, ruthenium or iron compounds as hydroformylation catalysts for the hydroformylation of ethylenically unsaturated compounds; by-product inhibition; improved industrial scale reaction rates RPIA, ESR2, CBR1 TOP1 456/4885ELANE 3518/4885ALDH1A1 272/4885

“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.

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