SCHEMBL258833

SCHEMBL258833

COc1ccc(OC)c([P@@](C)(=O)c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.48
▸ MEN1 O00255 4/20 0.46
▸ MAPT P10636 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ CA14 Q9ULX7 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ HDAC4 P56524 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ TTR P02766 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ HSD11B1 P28845 1/20 0.43

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
SCHEMBL258525 1.00 KMT2A (0.48) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL258526 1.00 KMT2A (0.48) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL6130221 0.87 KMT2A (0.62) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL3787871 0.83 KMT2A (0.52) KMT2AMEN1MAPTCA12CA1
SCHEMBL3805335 0.82 CA12 (0.44) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL3787003 0.81 KMT2A (0.44) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL23658965 0.80 KMT2A (0.60) KMT2AMEN1NPC1RAB9ACA12
SCHEMBL4924251 0.80 KMT2A (0.60) KMT2AMEN1NPC1RAB9ACA12
SCHEMBL3791443 0.80 KMT2A (0.60) KMT2AMEN1NPC1RAB9ACA12
SCHEMBL31326080 0.80 KMT2A (0.60) KMT2AMEN1NPC1RAB9ACA12

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-8067642-B2 Chiral phosphorous compounds Celtice Catalysts Limited, Nova UCD (IE) 2011-11-29 — — US disclosed
US-20100168456-A1 CHIRAL PHOSPHOROUS COMPOUNDS CELTIC CATALYSTS LIMITED (IE) 2010-07-01 — — 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-20100168456-A1 CHIRAL PHOSPHOROUS COMPOUNDS RPP30, PLCB3, INPP5D KMT2A 4432/4885MEN1 544/4885MAPT 4587/4885

“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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